2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid
TL;DR: 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid (CAS 174533-75-6) is a chemical compound with molecular formula C15H11ClN2O2 and molecular weight 286.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methyl]-3H-benzimidazole-5-carboxylic acid
Also Known As: 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid, 2-[(4-chlorophenyl)methyl]-3H-benzimidazole-5-carboxylic acid, 2-[(4-chlorophenyl)methyl]-3H-benzoimidazole-5-carboxylic Acid
| Molecular Formula | C15H11ClN2O2 |
|---|---|
| Molecular Weight | 286.05 g/mol |
| LogP | 3.5053 |
| Topological Polar Surface Area | 65.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.0509 |
| Heavy Atoms | 20 |
| Complexity | 778.1728 |
Chemical Identifiers
| CAS Number | 174533-75-6 |
|---|---|
| SMILES | C1=CC(=CC=C1CC2=NC3=C(N2)C=C(C=C3)C(=O)O)Cl |
Product Overview
2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid (CAS 174533-75-6), with molecular formula C15H11ClN2O2 and molecular weight 286.05 g/mol. IUPAC: 2-[(4-chlorophenyl)methyl]-3H-benzimidazole-5-carboxylic acid.
Chemical Property Profile of 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid
Property Insights of 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid
The XLogP value of 3.5053 indicates that 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid. Following Lipinski's Rule of Five, 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid has 2 hydrogen bond donor(s) and 2 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 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid?
The CAS number of 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid is 174533-75-6.
What is the molecular formula of 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid?
The molecular formula of 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid is C15H11ClN2O2.
What is the molecular weight of 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid?
The molecular weight of 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid is 286.05 g/mol.
Where can I buy 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid?
You can request a quote for 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorobenzyl)-1H-benzo[d]imidazole-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.