1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester
TL;DR: 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester (CAS 282091-91-2) is a chemical compound with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(2-hydroxyethyl)-2-methylbenzimidazole-5-carboxylate
Also Known As: ChemDiv3_000317, IDI1_019635, BAS 00004196, BRD-K18642314-001-01-3, methyl 1-(2-hydroxyethyl)-2-methylbenzimidazole-5-carboxylate
| Molecular Formula | C12H14N2O3 |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.10045 |
| Heavy Atoms | 17 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 282091-91-2 |
|---|---|
| SMILES | CC1=NC2=C(N1CCO)C=CC(=C2)C(=O)OC |
| InChIKey | KVOLIKDJFHDFHR-UHFFFAOYSA-N |
Product Overview
1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester (CAS 282091-91-2), with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol. IUPAC: methyl 1-(2-hydroxyethyl)-2-methylbenzimidazole-5-carboxylate.
Chemical Property Profile of 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester
Property Insights of 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester. Following Lipinski's Rule of Five, 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester?
The CAS number of 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester is 282091-91-2.
What is the molecular formula of 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester?
The molecular formula of 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester is C12H14N2O3.
What is the molecular weight of 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester?
The molecular weight of 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester is 234.10 g/mol.
Where can I buy 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester?
You can request a quote for 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Hydroxy-ethyl)-2-methyl-1H-benzoimidazole-5-carboxylic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.