![Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate structure](/static/products/488/488803-92-5.png)
Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate
TL;DR: Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate (CAS 488803-92-5) is a chemical compound with molecular formula C22H27N5O4 and molecular weight 425.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate
Also Known As: ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate, ethyl 4-(3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl)piperazine-1-carboxylate
| Molecular Formula | C22H27N5O4 |
|---|---|
| Molecular Weight | 425.21 g/mol |
| LogP | 2.85878 |
| Topological Polar Surface Area | 108.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 425.2063 |
| Heavy Atoms | 31 |
| Complexity | 966.0179 |
Chemical Identifiers
| CAS Number | 488803-92-5 |
|---|---|
| SMILES | CCCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C(=O)OCC |
Product Overview
Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate (CAS 488803-92-5), with molecular formula C22H27N5O4 and molecular weight 425.21 g/mol. IUPAC: ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate
Property Insights of Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate
The XLogP value of 2.85878 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate. The TPSA of 108.65 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate has 0 hydrogen bond donor(s) and 8 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-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate?
The CAS number of Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate is 488803-92-5.
What is the molecular formula of Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate?
The molecular formula of Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate is C22H27N5O4.
What is the molecular weight of Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate?
The molecular weight of Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate is 425.21 g/mol.
Where can I buy Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate?
You can request a quote for Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-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-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[3-(2-butoxy-1-cyano-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.