Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate
TL;DR: Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate (CAS 5428-31-9) is a chemical compound with molecular formula C18H15NO3 and molecular weight 293.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-oxo-6-phenyl-1H-quinoline-2-carboxylate
Also Known As: ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate, Ethyl 4-hydroxy-6-phenylquinoline-2-carboxylate, ethyl 4-hydroxy-6-phenyl-quinoline-2-carboxylate, ethyl 4-oxo-6-phenyl-1H-quinoline-2-carboxylate, 6-Phenyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-ol
| Molecular Formula | C18H15NO3 |
|---|---|
| Molecular Weight | 293.11 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.1052 |
| Heavy Atoms | 22 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 5428-31-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=O)C2=C(N1)C=CC(=C2)C3=CC=CC=C3 |
| InChIKey | CIKFPAYTONMDRZ-UHFFFAOYSA-N |
Product Overview
Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate (CAS 5428-31-9), with molecular formula C18H15NO3 and molecular weight 293.11 g/mol. IUPAC: ethyl 4-oxo-6-phenyl-1H-quinoline-2-carboxylate.
Chemical Property Profile of Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate
Property Insights of Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate
The XLogP value of 3.6 indicates that Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-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 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate?
The CAS number of Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate is 5428-31-9.
What is the molecular formula of Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate?
The molecular formula of Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate is C18H15NO3.
What is the molecular weight of Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate?
The molecular weight of Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate is 293.11 g/mol.
Where can I buy Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate?
You can request a quote for Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-oxo-6-phenyl-1,4-dihydroquinoline-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.