2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester
TL;DR: 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester (CAS 194713-18-3) is a chemical compound with molecular formula C19H21N3O3 and molecular weight 339.1583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-cyano-2-[4-(diethylcarbamoyl)quinolin-2-yl]acetate
Also Known As: Ethyl alpha-cyano-4-((diethylamino)carbonyl)-2-quinolineacetate, ethyl 2-cyano-2-[4-(diethylcarbamoyl)quinolin-2-yl]acetate, 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester, Ethyl cyano[4-(diethylcarbamoyl)quinolin-2-yl]acetate, 2-Quinolineacetic acid,a-cyano-4-[(diethylamino)carbonyl]-,ethyl ester
Technical Specifications
| Molecular Formula | C19H21N3O3 |
| Molecular Weight | 339.1583 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 83.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 339.1583 Da |
| Heavy Atoms | 25 |
| Complexity | 523.0 |
| SMILES | CCN(CC)C(=O)C1=CC(=NC2=CC=CC=C21)C(C#N)C(=O)OCC |
| InChIKey | NGNUSFJQSFZBSF-UHFFFAOYSA-N |
Chemical Property Profile of 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester
Property Insights of 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester. Following Lipinski's Rule of Five, 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester has 0 hydrogen bond donor(s) and 5 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-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester?
The CAS number of 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester is 194713-18-3.
What is the molecular formula of 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester?
The molecular formula of 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester is C19H21N3O3.
What is the molecular weight of 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester?
The molecular weight of 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester is 339.1583 g/mol.
Where can I buy 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester?
You can request a quote for 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for 2-Quinolineacetic acid, alpha-cyano-4-((diethylamino)carbonyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.