4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride
TL;DR: 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride (CAS 474092-18-7) is a chemical compound with molecular formula C20H18Cl2N2O4 and molecular weight 420.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(6-chloro-3-ethoxycarbonyl-8-methylquinolin-4-yl)amino]benzoic acid;hydrochloride
Also Known As: 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride, 4-[(6-chloro-3-ethoxycarbonyl-8-methyl-quinolin-4-yl)amino]benzoic Acid Hydrochloride, 4-[(6-chloro-3-ethoxycarbonyl-8-methylquinolin-4-yl)amino]benzoic acid hydrochloride
| Molecular Formula | C20H18Cl2N2O4 |
|---|---|
| Molecular Weight | 420.06 g/mol |
| LogP | 5.23692 |
| Topological Polar Surface Area | 88.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.06436 |
| Heavy Atoms | 28 |
| Complexity | 1036.5503 |
Chemical Identifiers
| CAS Number | 474092-18-7 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C2C(=CC(=CC2=C1NC3=CC=C(C=C3)C(=O)O)Cl)C.Cl |
Product Overview
4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride (CAS 474092-18-7), with molecular formula C20H18Cl2N2O4 and molecular weight 420.06 g/mol. IUPAC: 4-[(6-chloro-3-ethoxycarbonyl-8-methylquinolin-4-yl)amino]benzoic acid;hydrochloride.
Chemical Property Profile of 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride
Property Insights of 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride
The XLogP value of 5.23692 indicates that 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride 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 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride. Following Lipinski's Rule of Five, 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride?
The CAS number of 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride is 474092-18-7.
What is the molecular formula of 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride?
The molecular formula of 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride is C20H18Cl2N2O4.
What is the molecular weight of 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride?
The molecular weight of 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride is 420.06 g/mol.
Where can I buy 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride?
You can request a quote for 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-((6-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl)amino)benzoic acid hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.