3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester
TL;DR: 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester (CAS 88960-38-7) 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 2,6-dimethyl-4-oxo-1H-quinoline-3-carboxylate
Also Known As: 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester, BAS 12946007, ethyl 4-hydroxy-2,6-dimethylquinoline-3-carboxylate, J3.494.406G, VU0413061-2
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 2.32164 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 670.5288 |
Chemical Identifiers
| CAS Number | 88960-38-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1=O)C=C(C=C2)C)C |
Product Overview
3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester (CAS 88960-38-7), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: ethyl 2,6-dimethyl-4-oxo-1H-quinoline-3-carboxylate.
Chemical Property Profile of 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester
Property Insights of 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester
The XLogP value of 2.32164 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester. With a topological polar surface area (TPSA) of 59.16 Ų, 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, 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 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester?
The CAS number of 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester is 88960-38-7.
What is the molecular formula of 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester?
The molecular formula of 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester is C14H15NO3.
What is the molecular weight of 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester?
The molecular weight of 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester is 245.11 g/mol.
Where can I buy 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester?
You can request a quote for 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Quinolinecarboxylic acid, 4-hydroxy-2,6-dimethyl-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.