4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester
TL;DR: 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester (CAS 71083-10-8) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5,8-dimethyl-4-oxo-1H-quinoline-3-carboxylate
Also Known As: 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester, ETHYL 4-HYDROXY-5,8-DIMETHYLQUINOLINE-3-CARBOXYLATE, 5,8-Dimethyl-4-hydroxyquinoline-3-carboxylic acid ethyl ester, ethyl 5,8-dimethyl-4-oxo-1H-quinoline-3-carboxylate, 5J-046
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 71083-10-8 |
|---|---|
| SMILES | CCOC(=O)C1=CNC2=C(C=CC(=C2C1=O)C)C |
| InChIKey | HMUSWIYPMAPVDO-UHFFFAOYSA-N |
Product Overview
4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester (CAS 71083-10-8), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: ethyl 5,8-dimethyl-4-oxo-1H-quinoline-3-carboxylate.
Chemical Property Profile of 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester
Property Insights of 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester 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 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester?
The CAS number of 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester is 71083-10-8.
What is the molecular formula of 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester?
The molecular formula of 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester is C14H15NO3.
What is the molecular weight of 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester?
The molecular weight of 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester is 245.11 g/mol.
Where can I buy 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester?
You can request a quote for 4-Hydroxy-5,8-dimethylquinoline-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 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-5,8-dimethylquinoline-3-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.