Bionet1_000619
TL;DR: Bionet1_000619 (CAS 338396-66-0) is a chemical compound with molecular formula C20H22N4O4 and molecular weight 382.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-cyano-6-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-1H-pyridine-3-carboxylate
Also Known As: Bionet1_000619, ethyl 5-cyano-6-[4-(4-methoxyphenyl)piperazino]-2-oxo-1,2-dihydro-3-pyridinecarboxylate, ethyl 5-cyano-6-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-1,2-dihydropyridine-3-carboxylate, ethyl 5-cyano-6-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-1H-pyridine-3-carboxylate, ethyl 5-cyano-2-hydroxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyridine-3-carboxylate
| Molecular Formula | C20H22N4O4 |
|---|---|
| Molecular Weight | 382.16 g/mol |
| LogP | 1.75848 |
| Topological Polar Surface Area | 98.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.1641 |
| Heavy Atoms | 28 |
| Complexity | 938.15857 |
Chemical Identifiers
| CAS Number | 338396-66-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(NC1=O)N2CCN(CC2)C3=CC=C(C=C3)OC)C#N |
Product Overview
Bionet1_000619 (CAS 338396-66-0), with molecular formula C20H22N4O4 and molecular weight 382.16 g/mol. IUPAC: ethyl 5-cyano-6-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-1H-pyridine-3-carboxylate.
Chemical Property Profile of Bionet1_000619
Property Insights of Bionet1_000619
The XLogP value of 1.75848 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_000619. The TPSA of 98.66 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000619. Following Lipinski's Rule of Five, Bionet1_000619 has 1 hydrogen bond donor(s) and 7 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 Bionet1_000619?
The CAS number of Bionet1_000619 is 338396-66-0.
What is the molecular formula of Bionet1_000619?
The molecular formula of Bionet1_000619 is C20H22N4O4.
What is the molecular weight of Bionet1_000619?
The molecular weight of Bionet1_000619 is 382.16 g/mol.
Where can I buy Bionet1_000619?
You can request a quote for Bionet1_000619 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000619?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000619 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.