5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid
TL;DR: 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid (CAS 294892-04-9) is a chemical compound with molecular formula C16H12ClNO6 and molecular weight 349.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[2-(2-chlorophenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid
Also Known As: 5-(2-(2-chlorophenoxy)acetamido)isophthalic acid, AN-979/13513019, 5-{[(2-chlorophenoxy)acetyl]amino}isophthalic acid, 5-[[2-(2-chlorophenoxy)acetyl]amino]benzene-1,3-dicarboxylic Acid, 5-{[(2-chlorophenoxy)acetyl]amino}benzene-1,3-dicarboxylic acid
| Molecular Formula | C16H12ClNO6 |
|---|---|
| Molecular Weight | 349.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.0353 |
| Heavy Atoms | 24 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 294892-04-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)OCC(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)Cl |
| InChIKey | VQRWJJGRSWVBCQ-UHFFFAOYSA-N |
Product Overview
5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid (CAS 294892-04-9), with molecular formula C16H12ClNO6 and molecular weight 349.04 g/mol. IUPAC: 5-[[2-(2-chlorophenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid.
Chemical Property Profile of 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid
Property Insights of 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid. Following Lipinski's Rule of Five, 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid has 3 hydrogen bond donor(s) and 6 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-(2-Chlorophenoxy)acetamido)isophthalic acid?
The CAS number of 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid is 294892-04-9.
What is the molecular formula of 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid?
The molecular formula of 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid is C16H12ClNO6.
What is the molecular weight of 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid?
The molecular weight of 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid is 349.04 g/mol.
Where can I buy 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid?
You can request a quote for 5-(2-(2-Chlorophenoxy)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-(2-Chlorophenoxy)acetamido)isophthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-(2-Chlorophenoxy)acetamido)isophthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.