3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid
TL;DR: 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid (CAS 60134-45-4) is a chemical compound with molecular formula C18H13NO5 and molecular weight 323.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)quinoline-2,4-dicarboxylic acid
Also Known As: 3-(4-methoxyphenyl)-2,4-quinolinedicarboxylic acid, 3-(4-methoxyphenyl)quinoline-2,4-dicarboxylic acid, BIM-0039459.P001, AF-399/13278175
| Molecular Formula | C18H13NO5 |
|---|---|
| Molecular Weight | 323.08 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 96.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.07938 |
| Heavy Atoms | 24 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 60134-45-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N=C2C(=O)O)C(=O)O |
| InChIKey | CDWWIWDVXOQSLL-UHFFFAOYSA-N |
Product Overview
3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid (CAS 60134-45-4), with molecular formula C18H13NO5 and molecular weight 323.08 g/mol. IUPAC: 3-(4-methoxyphenyl)quinoline-2,4-dicarboxylic acid.
Chemical Property Profile of 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid
Property Insights of 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid
The XLogP value of 3.2 indicates that 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid. Following Lipinski's Rule of Five, 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid has 2 hydrogen bond donor(s) and 6 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-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid?
The CAS number of 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid is 60134-45-4.
What is the molecular formula of 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid?
The molecular formula of 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid is C18H13NO5.
What is the molecular weight of 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid?
The molecular weight of 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid is 323.08 g/mol.
Where can I buy 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid?
You can request a quote for 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methoxyphenyl)quinoline-2,4-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.