Category: imidazoles-derivatives

Infrared spectra and structure of salts of nitroimidazoles was written by Epishina, L. V.;Slovetskii, V. I.;Osipov, V. G.;Lebedev, O. V.;Khmel’nitskii, L. I.;Sevost’yanova, V. V.;Novikova, T. S.. And the article was included in Khimiya Geterotsiklicheskikh Soedinenii in 1967.COA of Formula: C4H5N3O2 This article mentions the following:

The ir spectra of nitroimidazoles and their salts indicate that salt formation involves only the NO2 group, with the formation of an isoimidazole ring. In polynitroimidazoles (I), only one NO2 group is involved as shown. The N-O absorption bands at �550 and �350 cm.-1 in mononitroimidazoles disappear on salt formation and bands at �180 and �50 cm.-1 appear. In salts of I, some of the N-O absorption in the uncharged NO2 group remains. N-Nitroimidazoles are characterized by an antisym. N-O vibration absorption band at �640 cm.-1 and a sym. one at �330 and �280 cm.-1 The presence of a C(NO2)3 group leads to 3 bands at 1600-1630 cm.-1 and usually to 2 bands at 1300-1325 cm.-1 In the experiment, the researchers used many compounds, for example, 1-Methyl-4-nitroimidazole (cas: 3034-41-1COA of Formula: C4H5N3O2).

1-Methyl-4-nitroimidazole (cas: 3034-41-1) belongs to imidazole derivatives. Many natural products, especially alkaloids, contain the imidazole ring. These imidazoles share the 1,3-C3N2 ring but feature varied substituents. Imidazole has been usedin the lysis, wash and elution buffer for the purification of histidine tagged Sonic Hedgehog(shh-N) protein, in elution buffer in stepwise gradient for the purification of histidine tagged aldo keto reductases using nickel affinity chromatography, as a component of homogenization buffer for the purification of phagosomal compartments from dendritic cells.COA of Formula: C4H5N3O2

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem

Effect of salt formation on γ-cyclodextrin solubilization of irbesartan and candesartan and the chemical stability of their ternary complexes was written by Jansook, Phatsawee;Hnin, Hay Marn;Praphanwittaya, Pitsiree;Loftsson, Thorsteinn;Stefansson, Einar. And the article was included in Journal of Drug Delivery Science and Technology in 2022.Electric Literature of C33H34N6O6 This article mentions the following:

Angiotensin II receptor blockers (ARBs) are unstable compounds and have relatively low aqueous solubility, which may hamper their bioavailability. The present study aimed to increase the aqueous solubility of ARBs by the formation of cyclodextrin (CD) inclusion complex and determine their chem. stability in aqueous solutions The pH- solubility of drugs and their phase-solubility profiles were determined, and the results showed that the solubility of drugs increased by forming inclusion complexes with γ-cyclodextrin (γCD) and by increasing their intrinsic solubility in phosphate buffer (pH 7.5). The formation of irbesartan/γCD (IRB/γCD) and candesartan cilexetil/γCD (CAC/γCD) inclusion complexes was confirmed by mol. docking. To enhance the γCD solubilization of drugs, salt formation using various organic salts was also investigated. Of these, Tris was the most powerful, followed by sodium acetate, as they significantly increased the γCD solubilization of IRB and CAC. However, chem. instability was observed, particularly at high salt concentrations, where they provided a higher IRB and CAC solubility Thus, the balance of optimum drug solubility and its chem. stability in aqueous solutions should be considered in formulation development. In the experiment, the researchers used many compounds, for example, 1-(((Cyclohexyloxy)carbonyl)oxy)ethyl 1-((2′-(2H-tetrazol-5-yl)-[1,1′-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate (cas: 145040-37-5Electric Literature of C33H34N6O6).

1-(((Cyclohexyloxy)carbonyl)oxy)ethyl 1-((2′-(2H-tetrazol-5-yl)-[1,1′-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate (cas: 145040-37-5) belongs to imidazole derivatives. 1H-imidazole is an imidazole tautomer which has the migrating hydrogen at position 1. It is a conjugate base of an imidazolium cation. It is a conjugate acid of an imidazolide. It is a tautomer of a 4H-imidazole. Imidazole also acts as a microtubule destabilizing agents and inhibits topoisomerase and Cytochrome P450 Family 26 Subfamily A Member 1 (CYP26A1) enzymes.Electric Literature of C33H34N6O6

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem

Novel Aryl and Heteroaryl Acyl Sulfamide Synthesis via Microwave-Assisted Palladium-Catalyzed Carbonylation was written by Roberts, Bryan;Liptrot, David;Alcaraz, Lilian. And the article was included in Organic Letters in 2010.SDS of cas: 25676-75-9 This article mentions the following:

A novel, simple synthesis of aryl and heteroaryl acyl sulfamides has been developed via palladium-catalyzed carbonylation of aryl or heteroaryl halides in the presence of sulfamide nucleophiles. A range of reactions illustrating the wide scope of this reaction was carried out under microwave irradiation in a vessel equipped with a gas inlet adapter and proceeded in good to excellent yields. In the experiment, the researchers used many compounds, for example, 4-Bromo-1-methylimidazole (cas: 25676-75-9SDS of cas: 25676-75-9).

4-Bromo-1-methylimidazole (cas: 25676-75-9) belongs to imidazole derivatives. The solubility of imidazoles in ethers is lower than that in alcohols and decreases with increasing chain length of the ethers . In contrast, the solubility of benzimidazoles in alcohols (C3–C6) is higher than in water and generally decreases with a Imidazole has been usedin the lysis, wash and elution buffer for the purification of histidine tagged Sonic Hedgehog(shh-N) protein, in elution buffer in stepwise gradient for the purification of histidine tagged aldo keto reductases using nickel affinity chromatography, as a component of homogenization buffer for the purification of phagosomal compartments from dendritic cells.SDS of cas: 25676-75-9

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem

Chemoselective iodination of 6-substituted imidazo[1,2-a]pyridine was written by Zhao, Chunshen;Li, Fei;Yang, Shuo;Liu, Li;Huang, Zhuyan;Chai, Huifang. And the article was included in Chemistry of Heterocyclic Compounds (New York, NY, United States) in 2018.Computed Properties of C7H5N3O2 This article mentions the following:

3- And 8-Iodoimidazo[1,2-a]pyridines were synthesized from imidazo[1,2-a]pyridines under different substitution conditions. The mol. electrostatic potential calculations were performed to investigate the chemoselectivity of the substitution reaction. The mol. structures of the target compounds were characterized by single crystal X-ray diffraction anal. In the experiment, the researchers used many compounds, for example, 6-Nitroimidazo[1,2-a]pyridine (cas: 25045-82-3Computed Properties of C7H5N3O2).

6-Nitroimidazo[1,2-a]pyridine (cas: 25045-82-3) belongs to imidazole derivatives. Many natural products, especially alkaloids, contain the imidazole ring. These imidazoles share the 1,3-C3N2 ring but feature varied substituents. Imidazole is incorporated into many important biological compounds. The most pervasive is the amino acid histidine, which has an imidazole side-chain. Histidine is present in many proteins and enzymes, e.g. by binding metal cofactors, as seen in hemoglobin.Computed Properties of C7H5N3O2

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem

Toward Designing “Sweet” Ionic Liquids Containing a Natural Terpene Moiety as Effective Wood Preservatives was written by Feder-Kubis, Joanna;Zabielska-Matejuk, Jadwiga;Stangierska, Anna;Przybylski, Piotr;Jacquemin, Johan;Geppert-Rybczynska, Monika. And the article was included in ACS Sustainable Chemistry & Engineering in 2019.Category: imidazoles-derivatives This article mentions the following:

This study is focused on the utilization of naturally occurring terpene alc. in the synthesis of ionic liquids (ILs) and their application potential in wood protection. A new series of ILs containing a natural, renewable source of (-)-menthol in the cation and a saccharinate derivative as the anion were obtained with a high yield under mild process conditions. The potential applications of synthesized compounds that belong to surface-active compounds were assessed for wood preservation, and they showed pos. results. Laboratory tests of their activity against fungi and saccharinate-based chiral ionic liquid (CIL) bonding with Scots pine (Pinus sylvestris L.) wood are described. The biol. results for salts with alkyl substituents ranging from pentyl to octyl chains are very promising, and their activity is similar to, and even higher than, that of the commonly used material benzalkonium chloride. The fungicidal values of saccharinate-based CILs against Coniophora puteana ranged from 2.75 to 4.4 kg m^-3 and were lower than those of com. benzalkonium chloride. Moreover, those salts penetrate to some extent into pine wood, which strongly increases their potential for use in wood industries. The attenuated total reflectance IR spectroscopy technique was used to characterize the fixing mechanism of the chiral “sweet” salts in the wood structure, and the CIL penetration depth into Scots pine wood was tested. These results were completed with the surface properties of the investigated saccharinates, the surface tension measurements, and contact angles of ILs on wood. The corrosiveness study of imidazolium saccharinate salt showed low aggressiveness against carbon steel, moreover, lower than that of IL with nitrate anion, didecyldimethylammonium nitrate, and com. used benzalkonium chloride. The incorporation of a saccharinate anion into the IL structure may eliminate this unfavorable property of com. protective agents based on ILs. In the experiment, the researchers used many compounds, for example, 1-Octyl-1H-imidazole (cas: 21252-69-7Category: imidazoles-derivatives).

1-Octyl-1H-imidazole (cas: 21252-69-7) belongs to imidazole derivatives. 1H-imidazole is an imidazole tautomer which has the migrating hydrogen at position 1. It is a conjugate base of an imidazolium cation. It is a conjugate acid of an imidazolide. It is a tautomer of a 4H-imidazole. Imidazole based anticancer drug find applications in cancer chemotherapy. It is used as buffer component for purification of the histidine tagged recombinant proteins in immobilized metal-affinity chromatography (IMAC).Category: imidazoles-derivatives

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem

Insights into the influence of the molecular structures of fluorinated ionic liquids on their thermophysical properties. A soft-SAFT based approach was written by Ferreira, Margarida L.;Araujo, Joao M. M.;Pereiro, Ana B.;Vega, Lourdes F.. And the article was included in Physical Chemistry Chemical Physics in 2019.Recommanded Product: 3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide This article mentions the following:

Fluorinated ionic liquids (FILs) are a unique family of ionic liquids with remarkable properties, including the formation of 3 nano-segregated domains, which are very attractive for several emerging applications. However, the amount of available exptl. data to fully characterize them is very scarce. The authors propose a systematic methodol. to build FIL transferable mol. models within the soft-SAFT framework to describe the behavior of FILs and their mixtures A total of 38 FILs (pyridinium- and imidazolium-based FILs conjugated with fluorinated anions such as [N(CF₃SO₂)₂]^–, [CF₃SO₃]^–, [CF₃CO₂]^–, [C₄F₉SO₃]^– and [C₄F₉CO₂]^–) were modeled for this purpose using available data, paying special attention to the phys. meaning of the parameters. The models are used to obtain mol. insights into the influence of the anion and cation mol. structures on the thermophys. properties of the FILs. The anion and anion fluorination are the leading features in the thermophys. properties studied, as captured by soft-SAFT. Models for 3 FILs not included in the parametrization study were built from the transferable parameters, in excellent agreement with exptl. data, underlining the robustness of the soft-SAFT approach. The methodol. presented here allows a direct connection between the mol. characteristics of the FILs, the influence on their behavior, and how this can be captured by a mol.-based equation of state. The procedure allows assembling FIL models with high predictive capabilities in an intuitive way regarding the process of parametrization from the mol. structure, allowing one to characterize their thermophys. behavior where limited exptl. data are available. In the experiment, the researchers used many compounds, for example, 3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide (cas: 404001-48-5Recommanded Product: 3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide).

3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide (cas: 404001-48-5) belongs to imidazole derivatives. 1H-imidazole is an imidazole tautomer which has the migrating hydrogen at position 1. It is a conjugate base of an imidazolium cation. It is a conjugate acid of an imidazolide. It is a tautomer of a 4H-imidazole. Imidazole also acts as a microtubule destabilizing agents and inhibits topoisomerase and Cytochrome P450 Family 26 Subfamily A Member 1 (CYP26A1) enzymes.Recommanded Product: 3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem

Structural effects on thermodynamic behavior and hydrogen bond interactions of water-ionic liquid systems was written by Jiang, Yifan;Wang, Zhenhang;Lei, Zhigang;Yu, Gangqiang. And the article was included in Chemical Engineering Science in 2021.Quality Control of 3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide This article mentions the following:

The relationships between the structure and the thermodn. behavior and the hydrogen bond (HB) interactions in H₂O + ionic liquid (IL) systems were systematically investigated for the first time. Imidazolium-based ILs comprising 1-alkyl-3-methylimidazolium cations ([RMIM]⁺) and various anions such as acetate ([AC]^–), thiocyanate ([SCN]^–), tetrafluoroborate ([BF₄]^–), and bis(trifluoromethylsulfonyl)imide ([Tf₂N]^–) were investigated. The vapor-liquid equilibrium (VLE) of H₂O + IL systems was exptl. determined and predicted by the UNIFAC-Lei model. The results demonstrated that the vapor pressure is mainly dependent on the type of anion and increases slightly with an increase in the cation alkyl chain length. Quantum chem. calculation and wavefunction anal. clearly revealed the relationship between the VLE and the HB interactions. This study provides theor. guidance for designing and screening task-specific ILs for chem. processes such as gas dehydration and dehumidification. In the experiment, the researchers used many compounds, for example, 3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide (cas: 404001-48-5Quality Control of 3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide).

3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide (cas: 404001-48-5) belongs to imidazole derivatives. The solubility of imidazoles in ethers is lower than that in alcohols and decreases with increasing chain length of the ethers . In contrast, the solubility of benzimidazoles in alcohols (C3–C6) is higher than in water and generally decreases with a Many drugs contain an imidazole ring, such as certain antifungal drugs, the nitroimidazole series of antibiotics, and the sedative midazolam.Quality Control of 3-Dodecyl-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem

New Procedure for the Synthesis of 2-Alkylbenzimidazoles was written by Yamashita, Tomohiro;Yamada, Shozo;Yamazaki, Yasundo;Tanaka, Hideo. And the article was included in Synthetic Communications in 2009.Synthetic Route of C15H22N2 This article mentions the following:

Simple, economical, and environmentally friendly method to synthesize 2-alkylbenzimidazoles, e.g., I (Et, n-octyl, c-hexyl), was developed by modifying the conventional method between o-phenylenediamine and aldehydes. In the experiment, the researchers used many compounds, for example, 2-Octylbenzimidazole (cas: 13060-24-7Synthetic Route of C15H22N2).

2-Octylbenzimidazole (cas: 13060-24-7) belongs to imidazole derivatives. Imidazole is a heterocyclic compound with a five-membered planar ring. It is amphoteric and highly polar. Imidazole is incorporated into many important biological compounds. The most pervasive is the amino acid histidine, which has an imidazole side-chain. Histidine is present in many proteins and enzymes, e.g. by binding metal cofactors, as seen in hemoglobin.Synthetic Route of C15H22N2

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem

Quantitative structure-activity relationship of benzimidazoles using molecular negentropy on the hepatic mixed-function oxidases inhibition was written by Buyukbingol, Erdem. And the article was included in Gazi Universitesi Eczacilik Fakultesi Dergisi in 1985.Electric Literature of C15H22N2 This article mentions the following:

A series of benzimidazole derivatives containing alkyl groups in the 2-position were studied to estimate the interaction with hepatic microsomal cytochrome P 450 inhibition, using a mol. negentropy parameter which is reflected in the topol. characters of the substituents. Although the lipophilicity of the substituent was the critical factor within a series of homologous compounds, on the basis of a regression equation it was observed that topol. character corroborated the correlation with biol. activity. In the experiment, the researchers used many compounds, for example, 2-Octylbenzimidazole (cas: 13060-24-7Electric Literature of C15H22N2).

2-Octylbenzimidazole (cas: 13060-24-7) belongs to imidazole derivatives. The solubility of imidazoles in ethers is lower than that in alcohols and decreases with increasing chain length of the ethers . In contrast, the solubility of benzimidazoles in alcohols (C3–C6) is higher than in water and generally decreases with a Imidazole has been usedin the lysis, wash and elution buffer for the purification of histidine tagged Sonic Hedgehog(shh-N) protein, in elution buffer in stepwise gradient for the purification of histidine tagged aldo keto reductases using nickel affinity chromatography, as a component of homogenization buffer for the purification of phagosomal compartments from dendritic cells.Electric Literature of C15H22N2

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem

Asymmetric [3 + 2] Cycloaddition Employing N,N’-Cyclic Azomethine Imines Catalyzed by Chiral-at-Metal Rhodium Complex was written by Gong, Jun;Wan, Qian;Kang, Qiang. And the article was included in Organic Letters in 2018.HPLC of Formula: 85692-37-1 This article mentions the following:

An efficient asym. 1,3-dipolar cycloaddition of α,β-unsaturated 2-acyl imidazoles with N,N’-cyclic azomethine imines catalyzed by a chiral-at-metal rhodium complex is reported. The corresponding N,N’-bicyclic pyrazolidine derivatives with three contiguous tertiary stereocenters, e.g., I, were obtained in good yields (up to 99%) with excellent stereoselectivities (>20:1 dr and >99% ee). Remarkably, as little as 0.5 mol % of a chiral Rh(III) complex can promote a gram-scale reaction with excellent yield and enantioselectivity. In the experiment, the researchers used many compounds, for example, 1-(1-Methyl-1H-imidazol-2-yl)ethanone (cas: 85692-37-1HPLC of Formula: 85692-37-1).

1-(1-Methyl-1H-imidazol-2-yl)ethanone (cas: 85692-37-1) belongs to imidazole derivatives. Imidazole is the basic core of some natural products such as histidine, purine, histamine and DNA based structures, etc. Among the different heterocyclic compounds, imidazole is better known due to its broad range of chemical and biological properties. Imidazole has been usedin the lysis, wash and elution buffer for the purification of histidine tagged Sonic Hedgehog(shh-N) protein, in elution buffer in stepwise gradient for the purification of histidine tagged aldo keto reductases using nickel affinity chromatography, as a component of homogenization buffer for the purification of phagosomal compartments from dendritic cells.HPLC of Formula: 85692-37-1

Referemce:
Imidazole – Wikipedia,
Imidazole | C3H4N2 – PubChem