Ethyl 2-(quinolin-4-YL)acetate
TL;DR: Ethyl 2-(quinolin-4-YL)acetate (CAS 4789-81-5) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-quinolin-4-ylacetate
Also Known As: ETHYL 2-(QUINOLIN-4-YL)ACETATE, ethyl 2-quinolin-4-ylacetate, Ethyl quinoline-4-acetate, ethyl 2-(4-quinolyl)acetate, Ethyl (quinolin-4-yl)acetate
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 2.3404 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 502.76367 |
Chemical Identifiers
| CAS Number | 4789-81-5 |
|---|---|
| SMILES | CCOC(=O)CC1=CC=NC2=CC=CC=C12 |
Product Overview
Ethyl 2-(quinolin-4-YL)acetate (CAS 4789-81-5), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: ethyl 2-quinolin-4-ylacetate.
Chemical Property Profile of Ethyl 2-(quinolin-4-YL)acetate
Property Insights of Ethyl 2-(quinolin-4-YL)acetate
The XLogP value of 2.3404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(quinolin-4-YL)acetate. With a topological polar surface area (TPSA) of 39.19 Ų, Ethyl 2-(quinolin-4-YL)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(quinolin-4-YL)acetate 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
Frequently Asked Questions
What is the CAS number of Ethyl 2-(quinolin-4-YL)acetate?
The CAS number of Ethyl 2-(quinolin-4-YL)acetate is 4789-81-5.
What is the molecular formula of Ethyl 2-(quinolin-4-YL)acetate?
The molecular formula of Ethyl 2-(quinolin-4-YL)acetate is C13H13NO2.
What is the molecular weight of Ethyl 2-(quinolin-4-YL)acetate?
The molecular weight of Ethyl 2-(quinolin-4-YL)acetate is 215.09 g/mol.
Where can I buy Ethyl 2-(quinolin-4-YL)acetate?
You can request a quote for Ethyl 2-(quinolin-4-YL)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(quinolin-4-YL)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(quinolin-4-YL)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.