4-Ethoxycarbonyl-2-quinolone
TL;DR: 4-Ethoxycarbonyl-2-quinolone (CAS 6325-41-3) is a chemical compound with molecular formula C12H11NO3 and molecular weight 217.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-oxo-1H-quinoline-4-carboxylate
Also Known As: ethyl 2-hydroxyquinoline-4-carboxylate, 4-Ethoxycarbonyl-2-quinolone, ethyl 2-oxo-1H-quinoline-4-carboxylate, 4-ethoxycarbonyl-2-quinolinone, ethyl2-hydroxyquinoline-4-carboxylate
| Molecular Formula | C12H11NO3 |
|---|---|
| Molecular Weight | 217.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.0739 |
| Heavy Atoms | 16 |
| Complexity | 335.0 |
| Solubility | 30.6 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 6325-41-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=O)NC2=CC=CC=C21 |
| InChIKey | WTHATVQLTWYSCI-UHFFFAOYSA-N |
Product Overview
4-Ethoxycarbonyl-2-quinolone (CAS 6325-41-3), with molecular formula C12H11NO3 and molecular weight 217.07 g/mol. IUPAC: ethyl 2-oxo-1H-quinoline-4-carboxylate.
Chemical Property Profile of 4-Ethoxycarbonyl-2-quinolone
Property Insights of 4-Ethoxycarbonyl-2-quinolone
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethoxycarbonyl-2-quinolone. With a topological polar surface area (TPSA) of 55.4 Ų, 4-Ethoxycarbonyl-2-quinolone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethoxycarbonyl-2-quinolone 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 4-Ethoxycarbonyl-2-quinolone?
The CAS number of 4-Ethoxycarbonyl-2-quinolone is 6325-41-3.
What is the molecular formula of 4-Ethoxycarbonyl-2-quinolone?
The molecular formula of 4-Ethoxycarbonyl-2-quinolone is C12H11NO3.
What is the molecular weight of 4-Ethoxycarbonyl-2-quinolone?
The molecular weight of 4-Ethoxycarbonyl-2-quinolone is 217.07 g/mol.
Where can I buy 4-Ethoxycarbonyl-2-quinolone?
You can request a quote for 4-Ethoxycarbonyl-2-quinolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethoxycarbonyl-2-quinolone?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethoxycarbonyl-2-quinolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.