![2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid structure](/static/products/2948/294891-25-1.webp)
2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid
TL;DR: 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid (CAS 294891-25-1) 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.
2-[(4-acetyloxybenzoyl)amino]-4-chlorobenzoic acid
Also Known As: MixCom6_001844, BIM-0032141.P001, 2-(4-acetoxybenzamido)-4-chlorobenzoic acid, 2-[(4-acetyloxybenzoyl)amino]-4-chlorobenzoic acid, 2-({[4-(acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid
| Molecular Formula | C16H12ClNO5 |
|---|---|
| Molecular Weight | 333.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.0404 |
| Heavy Atoms | 23 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 294891-25-1 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)C(=O)O |
| InChIKey | SZCXWCDLNZVMQZ-UHFFFAOYSA-N |
Product Overview
2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid (CAS 294891-25-1), with molecular formula C16H12ClNO5 and molecular weight 333.04 g/mol. IUPAC: 2-[(4-acetyloxybenzoyl)amino]-4-chlorobenzoic acid.
Chemical Property Profile of 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid
Property Insights of 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid
The XLogP value of 3.2 indicates that 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid. Following Lipinski's Rule of Five, 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid has 2 hydrogen bond donor(s) and 5 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-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid?
The CAS number of 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid is 294891-25-1.
What is the molecular formula of 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid?
The molecular formula of 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid is C16H12ClNO5.
What is the molecular weight of 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid?
The molecular weight of 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid is 333.04 g/mol.
Where can I buy 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid?
You can request a quote for 2-({[4-(Acetyloxy)phenyl]carbonyl}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-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-({[4-(Acetyloxy)phenyl]carbonyl}amino)-4-chlorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.