Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate
TL;DR: Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate (CAS 385389-27-5) is a chemical compound with molecular formula C13H12ClNO3 and molecular weight 265.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-chloro-2-oxo-1H-quinolin-3-yl)acetate
Also Known As: ethyl 2-(4-chloro-2-oxo-1H-quinolin-3-yl)acetate, ethyl (4-chloro-2-hydroxyquinolin-3-yl)acetate, ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate, ethyl 2-(4-chloro-2-oxo-1,2-dihydroquinolin-3-yl)acetate
| Molecular Formula | C13H12ClNO3 |
|---|---|
| Molecular Weight | 265.05 g/mol |
| LogP | 2.2871 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.05057 |
| Heavy Atoms | 18 |
| Complexity | 648.2167 |
Chemical Identifiers
| CAS Number | 385389-27-5 |
|---|---|
| SMILES | CCOC(=O)CC1=C(C2=CC=CC=C2NC1=O)Cl |
Product Overview
Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate (CAS 385389-27-5), with molecular formula C13H12ClNO3 and molecular weight 265.05 g/mol. IUPAC: ethyl 2-(4-chloro-2-oxo-1H-quinolin-3-yl)acetate.
Chemical Property Profile of Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate
Property Insights of Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate
The XLogP value of 2.2871 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate. With a topological polar surface area (TPSA) of 59.16 Ų, Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate 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 Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate?
The CAS number of Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate is 385389-27-5.
What is the molecular formula of Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate?
The molecular formula of Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate is C13H12ClNO3.
What is the molecular weight of Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate?
The molecular weight of Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate is 265.05 g/mol.
Where can I buy Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate?
You can request a quote for Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (4-chloro-2-oxo-1,2-dihydro-3-quinolinyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.