4-(6-amino-1H-benzimidazol-2-yl)benzoic acid
TL;DR: 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid (CAS 82289-46-1) 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.
4-(6-amino-1H-benzimidazol-2-yl)benzoic acid
Also Known As: 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid, BAS 00082637, 4-(5-amino-1h-benzimidazol-2-yl)benzoic acid, 4-(5-Amino-1H-benzoimidazol-2-yl)-benzoic acid, AE-641/32253062
| Molecular Formula | C14H11N3O2 |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 2.5103 |
| Topological Polar Surface Area | 92.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.08513 |
| Heavy Atoms | 19 |
| Complexity | 759.96204 |
Chemical Identifiers
| CAS Number | 82289-46-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)N)C(=O)O |
Product Overview
4-(6-amino-1H-benzimidazol-2-yl)benzoic acid (CAS 82289-46-1), with molecular formula C14H11N3O2 and molecular weight 253.09 g/mol. IUPAC: 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid.
Chemical Property Profile of 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid
Property Insights of 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid
The XLogP value of 2.5103 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid. The TPSA of 92.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid. Following Lipinski's Rule of Five, 4-(6-amino-1H-benzimidazol-2-yl)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 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid?
The CAS number of 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid is 82289-46-1.
What is the molecular formula of 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid?
The molecular formula of 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid is C14H11N3O2.
What is the molecular weight of 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid?
The molecular weight of 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid is 253.09 g/mol.
Where can I buy 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid?
You can request a quote for 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(6-amino-1H-benzimidazol-2-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.