2-Methylquinoline-3-carboxylic acid ethyl ester
TL;DR: 2-Methylquinoline-3-carboxylic acid ethyl ester (CAS 15785-08-7) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-methylquinoline-3-carboxylate
Also Known As: Ethyl 2-methylquinoline-3-carboxylate, 2-Methyl-quinoline-3-carboxylic acid ethyl ester, TimTec1_000111, 3-Quinolinecarboxylic acid, 2-methyl-, ethyl ester, QU015
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H13NO2 |
| Molecular Weight | 215.09464 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.09464 Da |
| Heavy Atoms | 16 |
| Complexity | 254.0 |
| SMILES | CCOC(=O)C1=CC2=CC=CC=C2N=C1C |
| InChIKey | DUBPJEDOCJXVKG-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methylquinoline-3-carboxylic acid ethyl ester
Property Insights of 2-Methylquinoline-3-carboxylic acid ethyl ester
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylquinoline-3-carboxylic acid ethyl ester. With a topological polar surface area (TPSA) of 39.2 Ų, 2-Methylquinoline-3-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylquinoline-3-carboxylic acid ethyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Methylquinoline-3-carboxylic acid ethyl ester?
The CAS number of 2-Methylquinoline-3-carboxylic acid ethyl ester is 15785-08-7.
What is the molecular formula of 2-Methylquinoline-3-carboxylic acid ethyl ester?
The molecular formula of 2-Methylquinoline-3-carboxylic acid ethyl ester is C13H13NO2.
What is the molecular weight of 2-Methylquinoline-3-carboxylic acid ethyl ester?
The molecular weight of 2-Methylquinoline-3-carboxylic acid ethyl ester is 215.09464 g/mol.
Where can I buy 2-Methylquinoline-3-carboxylic acid ethyl ester?
You can request a quote for 2-Methylquinoline-3-carboxylic acid ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methylquinoline-3-carboxylic acid ethyl ester?
Yes, CoreyChem provides custom synthesis services for 2-Methylquinoline-3-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.