![4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid structure](/static/products/294/294892-05-0.png)
4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid
TL;DR: 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid (CAS 294892-05-0) is a chemical compound with molecular formula C16H14ClNO4 and molecular weight 319.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid
Also Known As: 4-Chloro-2-(2-m-tolyloxy-acetylamino)-benzoic acid, 4-chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid, 4-chloro-2-(2-(m-tolyloxy)acetamido)benzoic acid, AN-979/13513020, 4-chloro-2-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid
| Molecular Formula | C16H14ClNO4 |
|---|---|
| Molecular Weight | 319.06 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.06113 |
| Heavy Atoms | 22 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 294892-05-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OCC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O |
| InChIKey | IVFHNSFOAQCNAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid (CAS 294892-05-0), with molecular formula C16H14ClNO4 and molecular weight 319.06 g/mol. IUPAC: 4-chloro-2-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid.
Chemical Property Profile of 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid
Property Insights of 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid
The XLogP value of 3.9 indicates that 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid has 2 hydrogen bond donor(s) and 4 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-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid?
The CAS number of 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid is 294892-05-0.
What is the molecular formula of 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid?
The molecular formula of 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid is C16H14ClNO4.
What is the molecular weight of 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid?
The molecular weight of 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid is 319.06 g/mol.
Where can I buy 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid?
You can request a quote for 4-Chloro-2-{[(3-methylphenoxy)acetyl]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-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-{[(3-methylphenoxy)acetyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.