3-(1H-benzimidazol-2-ylamino)benzoic acid
TL;DR: 3-(1H-benzimidazol-2-ylamino)benzoic acid (CAS 197792-99-7) is a chemical compound with molecular formula C14H11N3O2 and molecular weight 253.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-benzimidazol-2-ylamino)benzoic acid
Also Known As: 3-(1H-benzimidazol-2-ylamino)benzoic acid, BAS 05882039, 3-(benzimidazol-2-ylamino)benzoic acid, 3-(1H-Benzoimidazole-2-ylamino)benzoic acid, BB 0247839
| Molecular Formula | C14H11N3O2 |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 3.0047 |
| Topological Polar Surface Area | 78.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.08513 |
| Heavy Atoms | 19 |
| Complexity | 716.0407 |
Chemical Identifiers
| CAS Number | 197792-99-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)NC3=CC=CC(=C3)C(=O)O |
Product Overview
3-(1H-benzimidazol-2-ylamino)benzoic acid (CAS 197792-99-7), with molecular formula C14H11N3O2 and molecular weight 253.09 g/mol. IUPAC: 3-(1H-benzimidazol-2-ylamino)benzoic acid.
Chemical Property Profile of 3-(1H-benzimidazol-2-ylamino)benzoic acid
Property Insights of 3-(1H-benzimidazol-2-ylamino)benzoic acid
The XLogP value of 3.0047 indicates that 3-(1H-benzimidazol-2-ylamino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1H-benzimidazol-2-ylamino)benzoic acid. Following Lipinski's Rule of Five, 3-(1H-benzimidazol-2-ylamino)benzoic acid has 3 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 3-(1H-benzimidazol-2-ylamino)benzoic acid?
The CAS number of 3-(1H-benzimidazol-2-ylamino)benzoic acid is 197792-99-7.
What is the molecular formula of 3-(1H-benzimidazol-2-ylamino)benzoic acid?
The molecular formula of 3-(1H-benzimidazol-2-ylamino)benzoic acid is C14H11N3O2.
What is the molecular weight of 3-(1H-benzimidazol-2-ylamino)benzoic acid?
The molecular weight of 3-(1H-benzimidazol-2-ylamino)benzoic acid is 253.09 g/mol.
Where can I buy 3-(1H-benzimidazol-2-ylamino)benzoic acid?
You can request a quote for 3-(1H-benzimidazol-2-ylamino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-benzimidazol-2-ylamino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-benzimidazol-2-ylamino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.