![Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate structure](/static/products/797/797766-76-8.png)
Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
TL;DR: Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate (CAS 797766-76-8) is a chemical compound with molecular formula C21H26N4O2 and molecular weight 366.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-cyano-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
Also Known As: butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate, butyl 2-cyano-2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)acetate, butyl 2-cyano-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
| Molecular Formula | C21H26N4O2 |
|---|---|
| Molecular Weight | 366.21 g/mol |
| LogP | 3.81658 |
| Topological Polar Surface Area | 79.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.20557 |
| Heavy Atoms | 27 |
| Complexity | 837.6808 |
Chemical Identifiers
| CAS Number | 797766-76-8 |
|---|---|
| SMILES | CCCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCC(CC3)C |
Product Overview
Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate (CAS 797766-76-8), with molecular formula C21H26N4O2 and molecular weight 366.21 g/mol. IUPAC: butyl 2-cyano-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate.
Chemical Property Profile of Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
Property Insights of Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
The XLogP value of 3.81658 indicates that Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate. Following Lipinski's Rule of Five, Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate has 0 hydrogen bond donor(s) and 6 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 Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
The CAS number of Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate is 797766-76-8.
What is the molecular formula of Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
The molecular formula of Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate is C21H26N4O2.
What is the molecular weight of Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
The molecular weight of Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate is 366.21 g/mol.
Where can I buy Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
You can request a quote for Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Butyl cyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.