2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid
TL;DR: 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid (CAS 667403-76-1) is a chemical compound with molecular formula C19H20ClNO4 and molecular weight 361.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(2-butan-2-ylphenoxy)acetyl]amino]-4-chlorobenzoic acid
Also Known As: 2-({[2-(butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid, 2-(2-(2-(sec-butyl)phenoxy)acetamido)-4-chlorobenzoic acid, 2-[[2-(2-butan-2-ylphenoxy)acetyl]amino]-4-chloro-benzoic Acid, 2-[[2-(2-butan-2-ylphenoxy)acetyl]amino]-4-chlorobenzoic acid
| Molecular Formula | C19H20ClNO4 |
|---|---|
| Molecular Weight | 361.11 g/mol |
| LogP | 4.5692 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 361.1081 |
| Heavy Atoms | 25 |
| Complexity | 775.7695 |
Chemical Identifiers
| CAS Number | 667403-76-1 |
|---|---|
| SMILES | CCC(C)C1=CC=CC=C1OCC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O |
Product Overview
2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid (CAS 667403-76-1), with molecular formula C19H20ClNO4 and molecular weight 361.11 g/mol. IUPAC: 2-[[2-(2-butan-2-ylphenoxy)acetyl]amino]-4-chlorobenzoic acid.
Chemical Property Profile of 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid
Property Insights of 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid
The XLogP value of 4.5692 indicates that 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic 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 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid. Following Lipinski's Rule of Five, 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic 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 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid?
The CAS number of 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid is 667403-76-1.
What is the molecular formula of 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid?
The molecular formula of 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid is C19H20ClNO4.
What is the molecular weight of 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid?
The molecular weight of 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid is 361.11 g/mol.
Where can I buy 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid?
You can request a quote for 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-({[2-(Butan-2-yl)phenoxy]acetyl}amino)-4-chlorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.