![5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid structure](/static/products/7418/74185-94-7.webp)
5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid
TL;DR: 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid (CAS 74185-94-7) is a chemical compound with molecular formula C17H14N2O6 and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[3-(4-aminophenyl)-3-oxopropanoyl]amino]benzene-1,3-dicarboxylic acid
Also Known As: BAS 00004330, 5-(3-(4-aminophenyl)-3-oxopropanamido)isophthalic acid, 5-[3-(4-Amino-phenyl)-3-oxo-propionylamino]-isophthalic acid, 5-{[3-(4-aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid, 5-[[3-(4-aminophenyl)-3-oxo-propanoyl]amino]benzene-1,3-dicarboxylic acid
| Molecular Formula | C17H14N2O6 |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 1.8767 |
| Topological Polar Surface Area | 146.79 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.08517 |
| Heavy Atoms | 25 |
| Complexity | 825.69183 |
Chemical Identifiers
| CAS Number | 74185-94-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CC(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)N |
Product Overview
5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid (CAS 74185-94-7), with molecular formula C17H14N2O6 and molecular weight 342.09 g/mol. IUPAC: 5-[[3-(4-aminophenyl)-3-oxopropanoyl]amino]benzene-1,3-dicarboxylic acid.
Chemical Property Profile of 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid
Property Insights of 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid
The XLogP value of 1.8767 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid. The TPSA of 146.79 Ų indicates high polarity, suggesting 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid has 4 hydrogen bond donor(s) and 5 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 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid?
The CAS number of 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid is 74185-94-7.
What is the molecular formula of 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid?
The molecular formula of 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid is C17H14N2O6.
What is the molecular weight of 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid?
The molecular weight of 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid is 342.09 g/mol.
Where can I buy 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid?
You can request a quote for 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-{[3-(4-Aminophenyl)-3-oxopropanoyl]amino}benzene-1,3-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.