![3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid structure](/static/products/3838/383898-75-7.webp)
3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid
TL;DR: 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid (CAS 383898-75-7) is a chemical compound with molecular formula C20H17ClN2O4 and molecular weight 384.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(7-chloro-3-ethoxycarbonyl-8-methylquinolin-4-yl)amino]benzoic acid
Also Known As: 3-{[7-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid, 3-((7-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid, 3-[(7-chloro-3-ethoxycarbonyl-8-methyl-quinolin-4-yl)amino]benzoic Acid, 3-[(7-chloro-3-ethoxycarbonyl-8-methylquinolin-4-yl)amino]benzoic acid, 3-{[7-chloro-3-(ethoxycarbonyl)-8-methyl-4-quinolyl]amino}benzoic acid
| Molecular Formula | C20H17ClN2O4 |
|---|---|
| Molecular Weight | 384.09 g/mol |
| LogP | 4.81512 |
| Topological Polar Surface Area | 88.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.08768 |
| Heavy Atoms | 27 |
| Complexity | 1049.5763 |
Chemical Identifiers
| CAS Number | 383898-75-7 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C2C(=C(C=CC2=C1NC3=CC=CC(=C3)C(=O)O)Cl)C |
Product Overview
3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid (CAS 383898-75-7), with molecular formula C20H17ClN2O4 and molecular weight 384.09 g/mol. IUPAC: 3-[(7-chloro-3-ethoxycarbonyl-8-methylquinolin-4-yl)amino]benzoic acid.
Chemical Property Profile of 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid
Property Insights of 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid
The XLogP value of 4.81512 indicates that 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid. Following Lipinski's Rule of Five, 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic 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 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid?
The CAS number of 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid is 383898-75-7.
What is the molecular formula of 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid?
The molecular formula of 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid is C20H17ClN2O4.
What is the molecular weight of 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid?
The molecular weight of 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid is 384.09 g/mol.
Where can I buy 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid?
You can request a quote for 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]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 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{[7-Chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.