![4-[(3,5-Dinitrobenzoyl)amino]benzoic acid structure](/static/products/6156/6156-20-3.webp)
4-[(3,5-Dinitrobenzoyl)amino]benzoic acid
TL;DR: 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid (CAS 6156-20-3) is a chemical compound with molecular formula C14H9N3O7 and molecular weight 331.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,5-dinitrobenzoyl)amino]benzoic acid
Also Known As: 4-[(3,5-dinitrobenzoyl)amino]benzoic acid, 4-(3,5-DINITROBENZAMIDO)BENZOIC ACID, J3.412.331D, 4-[(3,5-dinitrophenyl)carbonylamino]benzoic acid, 4-{[(3,5-dinitrophenyl)carbonyl]amino}benzoic acid
| Molecular Formula | C14H9N3O7 |
|---|---|
| Molecular Weight | 331.04 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.04404 |
| Heavy Atoms | 24 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 6156-20-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | FJQZNYGOAAJBIS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(3,5-Dinitrobenzoyl)amino]benzoic acid (CAS 6156-20-3), with molecular formula C14H9N3O7 and molecular weight 331.04 g/mol. IUPAC: 4-[(3,5-dinitrobenzoyl)amino]benzoic acid.
Chemical Property Profile of 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid
Property Insights of 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid. The TPSA of 158.0 Ų indicates high polarity, suggesting 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid has 2 hydrogen bond donor(s) and 7 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-[(3,5-Dinitrobenzoyl)amino]benzoic acid?
The CAS number of 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid is 6156-20-3.
What is the molecular formula of 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid?
The molecular formula of 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid is C14H9N3O7.
What is the molecular weight of 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid?
The molecular weight of 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid is 331.04 g/mol.
Where can I buy 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid?
You can request a quote for 4-[(3,5-Dinitrobenzoyl)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-[(3,5-Dinitrobenzoyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3,5-Dinitrobenzoyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.