Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate
TL;DR: Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate (CAS 892286-75-8) is a chemical compound with molecular formula C14H13NO4 and molecular weight 259.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-acetyl-4-oxo-1H-quinoline-6-carboxylate
Also Known As: ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate, ethyl 3-acetyl-4-oxo-1H-quinoline-6-carboxylate, ethyl3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate, 3-acetyl-4-keto-1H-quinoline-6-carboxylic acid ethyl ester, 3-acetyl-4-oxo-1H-quinoline-6-carboxylic acid ethyl ester
| Molecular Formula | C14H13NO4 |
|---|---|
| Molecular Weight | 259.08 g/mol |
| LogP | 1.9074 |
| Topological Polar Surface Area | 76.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.08447 |
| Heavy Atoms | 19 |
| Complexity | 714.948 |
Chemical Identifiers
| CAS Number | 892286-75-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C=C1)NC=C(C2=O)C(=O)C |
Product Overview
Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate (CAS 892286-75-8), with molecular formula C14H13NO4 and molecular weight 259.08 g/mol. IUPAC: ethyl 3-acetyl-4-oxo-1H-quinoline-6-carboxylate.
Chemical Property Profile of Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate
Property Insights of Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate
The XLogP value of 1.9074 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate. The TPSA of 76.23 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate. Following Lipinski's Rule of Five, Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate has 1 hydrogen bond donor(s) and 4 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-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate?
The CAS number of Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate is 892286-75-8.
What is the molecular formula of Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate?
The molecular formula of Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate is C14H13NO4.
What is the molecular weight of Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate?
The molecular weight of Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate is 259.08 g/mol.
Where can I buy Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate?
You can request a quote for Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-acetyl-4-oxo-1,4-dihydroquinoline-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.