5-Benzimidazolecarboxylic acid
TL;DR: 5-Benzimidazolecarboxylic acid (CAS 15788-16-6) is a chemical compound with molecular formula C8H6N2O2 and molecular weight 162.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3H-benzimidazole-5-carboxylic acid
Also Known As: 5-Benzimidazolecarboxylic acid, 1H-Benzimidazole-5-carboxylic acid, 1H-benzo[d]imidazole-5-carboxylic acid, Benzimidazole-5-carboxylic acid, 1H-benzimidazole-6-carboxylic acid
| Molecular Formula | C8H6N2O2 |
|---|---|
| Molecular Weight | 162.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 162.04292 |
| Heavy Atoms | 12 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 15788-16-6 |
|---|---|
| SMILES | C1=CC2=C(C=C1C(=O)O)NC=N2 |
| InChIKey | COYPLDIXZODDDL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Benzimidazolecarboxylic acid (CAS 15788-16-6), with molecular formula C8H6N2O2 and molecular weight 162.04 g/mol. IUPAC: 3H-benzimidazole-5-carboxylic acid.
Chemical Property Profile of 5-Benzimidazolecarboxylic acid
Property Insights of 5-Benzimidazolecarboxylic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Benzimidazolecarboxylic acid. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Benzimidazolecarboxylic acid. Following Lipinski's Rule of Five, 5-Benzimidazolecarboxylic acid has 2 hydrogen bond donor(s) and 3 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 5-Benzimidazolecarboxylic acid?
The CAS number of 5-Benzimidazolecarboxylic acid is 15788-16-6.
What is the molecular formula of 5-Benzimidazolecarboxylic acid?
The molecular formula of 5-Benzimidazolecarboxylic acid is C8H6N2O2.
What is the molecular weight of 5-Benzimidazolecarboxylic acid?
The molecular weight of 5-Benzimidazolecarboxylic acid is 162.04 g/mol.
Where can I buy 5-Benzimidazolecarboxylic acid?
You can request a quote for 5-Benzimidazolecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzimidazolecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzimidazolecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.