5-(2-(4-Chlorophenyl)acetamido)isophthalic acid
TL;DR: 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid (CAS 351424-31-2) is a chemical compound with molecular formula C16H12ClNO5 and molecular weight 333.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[2-(4-chlorophenyl)acetyl]amino]benzene-1,3-dicarboxylic acid
Also Known As: BIM-0041399.P001, 5-(2-(4-chlorophenyl)acetamido)isophthalic acid, 5-{[(4-chlorophenyl)acetyl]amino}isophthalic acid, AN-979/13513034, 5-[[2-(4-chlorophenyl)acetyl]amino]benzene-1,3-dicarboxylic acid
| Molecular Formula | C16H12ClNO5 |
|---|---|
| Molecular Weight | 333.04 g/mol |
| LogP | 2.9176 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.0404 |
| Heavy Atoms | 23 |
| Complexity | 738.2901 |
Chemical Identifiers
| CAS Number | 351424-31-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CC(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)Cl |
Product Overview
5-(2-(4-Chlorophenyl)acetamido)isophthalic acid (CAS 351424-31-2), with molecular formula C16H12ClNO5 and molecular weight 333.04 g/mol. IUPAC: 5-[[2-(4-chlorophenyl)acetyl]amino]benzene-1,3-dicarboxylic acid.
Chemical Property Profile of 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid
Property Insights of 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid
The XLogP value of 2.9176 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid. Following Lipinski's Rule of Five, 5-(2-(4-Chlorophenyl)acetamido)isophthalic 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 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid?
The CAS number of 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid is 351424-31-2.
What is the molecular formula of 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid?
The molecular formula of 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid is C16H12ClNO5.
What is the molecular weight of 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid?
The molecular weight of 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid is 333.04 g/mol.
Where can I buy 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid?
You can request a quote for 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-(4-Chlorophenyl)acetamido)isophthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.