![4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid structure](/static/products/6909/690987-20-3.webp)
4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid
TL;DR: 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid (CAS 690987-20-3) is a chemical compound with molecular formula C21H15BrN2O4 and molecular weight 438.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-[(3-bromobenzoyl)amino]benzoyl]amino]benzoic acid
Also Known As: 4-(2-(3-bromobenzamido)benzamido)benzoic acid, 4-[[2-[(3-bromobenzoyl)amino]benzoyl]amino]benzoic Acid, 4-({2-[(3-bromobenzoyl)amino]benzoyl}amino)benzoic acid, 4-{[(2-{[(3-bromophenyl)carbonyl]amino}phenyl)carbonyl]amino}benzoic acid
| Molecular Formula | C21H15BrN2O4 |
|---|---|
| Molecular Weight | 438.02 g/mol |
| LogP | 4.6519 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.0215 |
| Heavy Atoms | 28 |
| Complexity | 1048.281 |
Chemical Identifiers
| CAS Number | 690987-20-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O)NC(=O)C3=CC(=CC=C3)Br |
Product Overview
4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid (CAS 690987-20-3), with molecular formula C21H15BrN2O4 and molecular weight 438.02 g/mol. IUPAC: 4-[[2-[(3-bromobenzoyl)amino]benzoyl]amino]benzoic acid.
Chemical Property Profile of 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid
Property Insights of 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid
The XLogP value of 4.6519 indicates that 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid. Following Lipinski's Rule of Five, 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)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-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid?
The CAS number of 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid is 690987-20-3.
What is the molecular formula of 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid?
The molecular formula of 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid is C21H15BrN2O4.
What is the molecular weight of 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid?
The molecular weight of 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid is 438.02 g/mol.
Where can I buy 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid?
You can request a quote for 4-({2-[(3-Bromobenzoyl)amino]benzoyl}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 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-({2-[(3-Bromobenzoyl)amino]benzoyl}amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.