4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid
TL;DR: 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid (CAS 670232-62-9) is a chemical compound with molecular formula C18H18ClNO4 and molecular weight 347.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-[[2-(4-propan-2-ylphenoxy)acetyl]amino]benzoic acid
Also Known As: 4-chloro-2-[[2-(4-propan-2-ylphenoxy)acetyl]amino]benzoic Acid, 4-chloro-2-(2-(4-isopropylphenoxy)acetamido)benzoic acid, 4-chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid
| Molecular Formula | C18H18ClNO4 |
|---|---|
| Molecular Weight | 347.09 g/mol |
| LogP | 4.1791 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.09244 |
| Heavy Atoms | 24 |
| Complexity | 741.184 |
Chemical Identifiers
| CAS Number | 670232-62-9 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O |
Product Overview
4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid (CAS 670232-62-9), with molecular formula C18H18ClNO4 and molecular weight 347.09 g/mol. IUPAC: 4-chloro-2-[[2-(4-propan-2-ylphenoxy)acetyl]amino]benzoic acid.
Chemical Property Profile of 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid
Property Insights of 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid
The XLogP value of 4.1791 indicates that 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid. Following Lipinski's Rule of Five, 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid has 2 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 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid?
The CAS number of 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid is 670232-62-9.
What is the molecular formula of 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid?
The molecular formula of 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid is C18H18ClNO4.
What is the molecular weight of 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid?
The molecular weight of 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid is 347.09 g/mol.
Where can I buy 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid?
You can request a quote for 4-Chloro-2-({[4-(propan-2-yl)phenoxy]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-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-({[4-(propan-2-yl)phenoxy]acetyl}amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.