Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate
TL;DR: Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate (CAS 7151-80-6) is a chemical compound with molecular formula C16H17NO4 and molecular weight 287.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate
Also Known As: ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate, ethyl 3-(2-ethoxy-4-quinolyl)-3-oxo-propanoate, 4-Quinolinepropanoicacid, 2-ethoxy-b-oxo-, ethyl ester
| Molecular Formula | C16H17NO4 |
|---|---|
| Molecular Weight | 287.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 287.11575 |
| Heavy Atoms | 21 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 7151-80-6 |
|---|---|
| SMILES | CCOC1=NC2=CC=CC=C2C(=C1)C(=O)CC(=O)OCC |
| InChIKey | AMGPZCYRVJKNPP-UHFFFAOYSA-N |
Product Overview
Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate (CAS 7151-80-6), with molecular formula C16H17NO4 and molecular weight 287.12 g/mol. IUPAC: ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate.
Chemical Property Profile of Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate
Property Insights of Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate. Following Lipinski's Rule of Five, Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate 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
Frequently Asked Questions
What is the CAS number of Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate?
The CAS number of Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate is 7151-80-6.
What is the molecular formula of Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate?
The molecular formula of Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate is C16H17NO4.
What is the molecular weight of Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate?
The molecular weight of Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate is 287.12 g/mol.
Where can I buy Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate?
You can request a quote for Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(2-ethoxyquinolin-4-yl)-3-oxopropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.