![2-[(4-aminobenzoyl)amino]benzoic acid structure](/static/products/6049/60498-39-7.webp)
2-[(4-aminobenzoyl)amino]benzoic acid
TL;DR: 2-[(4-aminobenzoyl)amino]benzoic acid (CAS 60498-39-7) is a chemical compound with molecular formula C14H12N2O3 and molecular weight 256.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-aminobenzoyl)amino]benzoic acid
Also Known As: 2-[(4-aminobenzoyl)amino]benzoic acid, 2-(4-amino-benzoylamino)-benzoic acid, 2-(4-AMINOBENZAMIDO)BENZOIC ACID, Benzoic acid, 2-[(4-aminobenzoyl)amino]-, 2,3-(4-aminobenzamido)benzoic acid
| Molecular Formula | C14H12N2O3 |
|---|---|
| Molecular Weight | 256.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.08478 |
| Heavy Atoms | 19 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 60498-39-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC=C(C=C2)N |
| InChIKey | TWCZFZWZLLVQRA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(4-aminobenzoyl)amino]benzoic acid (CAS 60498-39-7), with molecular formula C14H12N2O3 and molecular weight 256.08 g/mol. IUPAC: 2-[(4-aminobenzoyl)amino]benzoic acid.
Chemical Property Profile of 2-[(4-aminobenzoyl)amino]benzoic acid
Property Insights of 2-[(4-aminobenzoyl)amino]benzoic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-aminobenzoyl)amino]benzoic acid. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-aminobenzoyl)amino]benzoic acid. Following Lipinski's Rule of Five, 2-[(4-aminobenzoyl)amino]benzoic acid has 3 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 2-[(4-aminobenzoyl)amino]benzoic acid?
The CAS number of 2-[(4-aminobenzoyl)amino]benzoic acid is 60498-39-7.
What is the molecular formula of 2-[(4-aminobenzoyl)amino]benzoic acid?
The molecular formula of 2-[(4-aminobenzoyl)amino]benzoic acid is C14H12N2O3.
What is the molecular weight of 2-[(4-aminobenzoyl)amino]benzoic acid?
The molecular weight of 2-[(4-aminobenzoyl)amino]benzoic acid is 256.08 g/mol.
Where can I buy 2-[(4-aminobenzoyl)amino]benzoic acid?
You can request a quote for 2-[(4-aminobenzoyl)amino]benzoic 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-aminobenzoyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-aminobenzoyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.