4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid
TL;DR: 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid (CAS 337337-33-4) is a chemical compound with molecular formula C13H12ClNO2 and molecular weight 249.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3-ethyl-2-methylquinoline-6-carboxylic acid
Also Known As: BAS 01256721, 4-chloro-3-ethyl-2-methylquinoline-6-carboxylic acid, BIM-0037949.P001, 4-Chloro-3-ethyl-2-methyl-quinoline-6-carboxylic acid
| Molecular Formula | C13H12ClNO2 |
|---|---|
| Molecular Weight | 249.06 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.05565 |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 337337-33-4 |
|---|---|
| SMILES | CCC1=C(N=C2C=CC(=CC2=C1Cl)C(=O)O)C |
| InChIKey | ZFXUIFLCUHCIMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid (CAS 337337-33-4), with molecular formula C13H12ClNO2 and molecular weight 249.06 g/mol. IUPAC: 4-chloro-3-ethyl-2-methylquinoline-6-carboxylic acid.
Chemical Property Profile of 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid
Property Insights of 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid
The XLogP value of 3.5 indicates that 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid 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 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid?
The CAS number of 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid is 337337-33-4.
What is the molecular formula of 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid?
The molecular formula of 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid is C13H12ClNO2.
What is the molecular weight of 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid?
The molecular weight of 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid is 249.06 g/mol.
Where can I buy 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid?
You can request a quote for 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3-ethyl-2-methylquinoline-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.