8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester
TL;DR: 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester (CAS 338795-13-4) is a chemical compound with molecular formula C13H12ClNO3 and molecular weight 265.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 8-chloro-6-methyl-4-oxo-1H-quinoline-3-carboxylate
Also Known As: 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester, ETHYL 8-CHLORO-4-HYDROXY-6-METHYLQUINOLINE-3-CARBOXYLATE, ethyl 8-chloro-4-hydroxy-6-methyl-3-quinolinecarboxylate, ethyl 8-chloro-6-methyl-4-oxo-1H-quinoline-3-carboxylate, Ethyl 8-chloro-6-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylate
| Molecular Formula | C13H12ClNO3 |
|---|---|
| Molecular Weight | 265.05 g/mol |
| LogP | 2.66662 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.05057 |
| Heavy Atoms | 18 |
| Complexity | 675.7261 |
Chemical Identifiers
| CAS Number | 338795-13-4 |
|---|---|
| SMILES | CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2Cl)C |
Product Overview
8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester (CAS 338795-13-4), with molecular formula C13H12ClNO3 and molecular weight 265.05 g/mol. IUPAC: ethyl 8-chloro-6-methyl-4-oxo-1H-quinoline-3-carboxylate.
Chemical Property Profile of 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester
Property Insights of 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester
The XLogP value of 2.66662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester. With a topological polar surface area (TPSA) of 59.16 Ų, 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester has 1 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 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester?
The CAS number of 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester is 338795-13-4.
What is the molecular formula of 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester?
The molecular formula of 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester is C13H12ClNO3.
What is the molecular weight of 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester?
The molecular weight of 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester is 265.05 g/mol.
Where can I buy 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester?
You can request a quote for 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.