![2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide structure](/static/products/3782/378208-28-7.webp)
2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide
TL;DR: 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide (CAS 378208-28-7) is a chemical compound with molecular formula C21H27N5O and molecular weight 365.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide
Also Known As: 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide, 2-(3-(azepan-1-yl)quinoxalin-2-yl)-N-butyl-2-cyanoacetamide, N-Butyl-I+/--cyano-3-(hexahydro-1H-azepin-1-yl)-2-quinoxalineacetamide
| Molecular Formula | C21H27N5O |
|---|---|
| Molecular Weight | 365.22 g/mol |
| LogP | 3.53368 |
| Topological Polar Surface Area | 81.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.22156 |
| Heavy Atoms | 27 |
| Complexity | 820.92206 |
Chemical Identifiers
| CAS Number | 378208-28-7 |
|---|---|
| SMILES | CCCCNC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCCCC3 |
Product Overview
2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide (CAS 378208-28-7), with molecular formula C21H27N5O and molecular weight 365.22 g/mol. IUPAC: 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide.
Chemical Property Profile of 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide
Property Insights of 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide
The XLogP value of 3.53368 indicates that 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide. Following Lipinski's Rule of Five, 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide has 1 hydrogen bond donor(s) and 5 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 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide?
The CAS number of 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide is 378208-28-7.
What is the molecular formula of 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide?
The molecular formula of 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide is C21H27N5O.
What is the molecular weight of 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide?
The molecular weight of 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide is 365.22 g/mol.
Where can I buy 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide?
You can request a quote for 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(azepan-1-yl)quinoxalin-2-yl]-N-butyl-2-cyanoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.