Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate
TL;DR: Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate (CAS 54401-82-0) is a chemical compound with molecular formula C17H14N2O3 and molecular weight 294.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-oxo-3-pyridin-2-ylquinolizine-1-carboxylate
Also Known As: Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate, ethyl 4-oxo-3-pyridin-2-ylquinolizine-1-carboxylate, J1.392.166K, Ethyl 4-oxo-3-(pyridin-2-yl)-4H-quinolizine-1-carboxylate, ethyl 4-oxo-3-(2-pyridyl)quinolizine-1-carboxylate
| Molecular Formula | C17H14N2O3 |
|---|---|
| Molecular Weight | 294.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 59.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.10043 |
| Heavy Atoms | 22 |
| Complexity | 613.0 |
Chemical Identifiers
| CAS Number | 54401-82-0 |
|---|---|
| SMILES | CCOC(=O)C1=C2C=CC=CN2C(=O)C(=C1)C3=CC=CC=N3 |
| InChIKey | YAVMUMPTDLVFQD-UHFFFAOYSA-N |
Product Overview
Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate (CAS 54401-82-0), with molecular formula C17H14N2O3 and molecular weight 294.10 g/mol. IUPAC: ethyl 4-oxo-3-pyridin-2-ylquinolizine-1-carboxylate.
Chemical Property Profile of Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate
Property Insights of Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate. With a topological polar surface area (TPSA) of 59.5 Ų, Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate has 0 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-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate?
The CAS number of Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate is 54401-82-0.
What is the molecular formula of Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate?
The molecular formula of Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate is C17H14N2O3.
What is the molecular weight of Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate?
The molecular weight of Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate is 294.10 g/mol.
Where can I buy Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate?
You can request a quote for Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-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-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-oxo-3-(2-pyridinyl)-4H-quinolizine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.