4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid
TL;DR: 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid (CAS 330634-73-6) is a chemical compound with molecular formula C16H11NO7 and molecular weight 329.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-carboxyphenyl)carbamoyl]phthalic acid
Also Known As: 4-[(4-carboxyphenyl)carbamoyl]phthalic acid, 4-[(4-CARBOXYANILINO)CARBONYL]PHTHALIC ACID, A1799/0076108, 4-[(4-carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid, 4-[N-(4-carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid
| Molecular Formula | C16H11NO7 |
|---|---|
| Molecular Weight | 329.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.05356 |
| Heavy Atoms | 24 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 330634-73-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)NC(=O)C2=CC(=C(C=C2)C(=O)O)C(=O)O |
| InChIKey | MMVZFNAEVYTFQB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid (CAS 330634-73-6), with molecular formula C16H11NO7 and molecular weight 329.05 g/mol. IUPAC: 4-[(4-carboxyphenyl)carbamoyl]phthalic acid.
Chemical Property Profile of 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid
Property Insights of 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid. The TPSA of 141.0 Ų indicates high polarity, suggesting 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid has 4 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-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid?
The CAS number of 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid is 330634-73-6.
What is the molecular formula of 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid?
The molecular formula of 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid is C16H11NO7.
What is the molecular weight of 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid?
The molecular weight of 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid is 329.05 g/mol.
Where can I buy 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid?
You can request a quote for 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Carboxyphenyl)carbamoyl]benzene-1,2-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.