N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide
TL;DR: N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide (CAS 722471-83-2) is a chemical compound with molecular formula C18H13ClN4O and molecular weight 336.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide
Also Known As: N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide
| Molecular Formula | C18H13ClN4O |
|---|---|
| Molecular Weight | 336.08 g/mol |
| LogP | 3.20678 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.0778 |
| Heavy Atoms | 24 |
| Complexity | 921.20013 |
Chemical Identifiers
| CAS Number | 722471-83-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)C(C#N)C2=NC3=CC=CC=C3N=C2Cl |
Product Overview
N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide (CAS 722471-83-2), with molecular formula C18H13ClN4O and molecular weight 336.08 g/mol. IUPAC: N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide.
Chemical Property Profile of N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide
Property Insights of N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide
The XLogP value of 3.20678 indicates that N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide. Following Lipinski's Rule of Five, N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide has 1 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 N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide?
The CAS number of N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide is 722471-83-2.
What is the molecular formula of N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide?
The molecular formula of N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide is C18H13ClN4O.
What is the molecular weight of N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide?
The molecular weight of N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide is 336.08 g/mol.
Where can I buy N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide?
You can request a quote for N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.