6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid
TL;DR: 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid (CAS 79544-27-7) is a chemical compound with molecular formula C18H14ClNO4 and molecular weight 343.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid
Also Known As: 6-chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid, 2-Bromo-6-fluorobenzonitrile, 6-chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylicacid
| Molecular Formula | C18H14ClNO4 |
|---|---|
| Molecular Weight | 343.06 g/mol |
| LogP | 4.2706 |
| Topological Polar Surface Area | 68.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.06113 |
| Heavy Atoms | 24 |
| Complexity | 939.69525 |
Chemical Identifiers
| CAS Number | 79544-27-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)O)OC |
Product Overview
6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid (CAS 79544-27-7), with molecular formula C18H14ClNO4 and molecular weight 343.06 g/mol. IUPAC: 6-chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid.
Chemical Property Profile of 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid
Property Insights of 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid
The XLogP value of 4.2706 indicates that 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid. Following Lipinski's Rule of Five, 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid has 1 hydrogen bond donor(s) and 4 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 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid?
The CAS number of 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid is 79544-27-7.
What is the molecular formula of 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid?
The molecular formula of 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid is C18H14ClNO4.
What is the molecular weight of 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid?
The molecular weight of 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid is 343.06 g/mol.
Where can I buy 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid?
You can request a quote for 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-2-(3,4-dimethoxyphenyl)quinoline-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.