![Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate structure](/static/products/577/577988-46-6.png)
Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate
TL;DR: Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate (CAS 577988-46-6) is a chemical compound with molecular formula C30H37N5O2 and molecular weight 499.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptyl 2-cyano-2-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl]acetate
Also Known As: Heptyl 2-cyano-2-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl]acetate, heptyl 2-cyano-2-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)quinoxalin-2-yl)acetate, heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate
| Molecular Formula | C30H37N5O2 |
|---|---|
| Molecular Weight | 499.29 g/mol |
| LogP | 5.69402 |
| Topological Polar Surface Area | 82.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 499.29474 |
| Heavy Atoms | 37 |
| Complexity | 1260.5516 |
Chemical Identifiers
| CAS Number | 577988-46-6 |
|---|---|
| SMILES | CCCCCCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C4=CC=CC(=C4C)C |
Product Overview
Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate (CAS 577988-46-6), with molecular formula C30H37N5O2 and molecular weight 499.29 g/mol. IUPAC: heptyl 2-cyano-2-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl]acetate.
Chemical Property Profile of Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate
Property Insights of Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate
The XLogP value of 5.69402 indicates that Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.35 Ų falls within the moderate polarity range, balancing permeability and solubility for Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate. Following Lipinski's Rule of Five, Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate?
The CAS number of Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate is 577988-46-6.
What is the molecular formula of Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate?
The molecular formula of Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate is C30H37N5O2.
What is the molecular weight of Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate?
The molecular weight of Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate is 499.29 g/mol.
Where can I buy Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate?
You can request a quote for Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-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 Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate?
Yes, KEHONG BIO provides custom synthesis services for Heptyl cyano{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.