![heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate structure](/static/products/585/585561-35-9.png)
heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate
TL;DR: heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate (CAS 585561-35-9) is a chemical compound with molecular formula C30H35N5O2 and molecular weight 497.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptyl 2-cyano-2-[3-[4-[(E)-2-phenylethenyl]piperazin-1-yl]quinoxalin-2-yl]acetate
Also Known As: (E)-heptyl 2-cyano-2-(3-(4-styrylpiperazin-1-yl)quinoxalin-2-yl)acetate, Heptyl 2-cyano-2-[3-[4-(2-phenylethenyl)piperazin-1-yl]quinoxalin-2-yl]acetate, heptyl 2-cyano-2-[3-[4-[(E)-2-phenylethenyl]piperazin-1-yl]quinoxalin-2-yl]acetate, heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate
| Molecular Formula | C30H35N5O2 |
|---|---|
| Molecular Weight | 497.28 g/mol |
| LogP | 5.54348 |
| Topological Polar Surface Area | 82.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 497.27908 |
| Heavy Atoms | 37 |
| Complexity | 1229.7003 |
Chemical Identifiers
| CAS Number | 585561-35-9 |
|---|---|
| SMILES | CCCCCCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)/C=C/C4=CC=CC=C4 |
Product Overview
heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate (CAS 585561-35-9), with molecular formula C30H35N5O2 and molecular weight 497.28 g/mol. IUPAC: heptyl 2-cyano-2-[3-[4-[(E)-2-phenylethenyl]piperazin-1-yl]quinoxalin-2-yl]acetate.
Chemical Property Profile of heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate
Property Insights of heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate
The XLogP value of 5.54348 indicates that heptyl cyano(3-{4-[(E)-2-phenylethenyl]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-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate. Following Lipinski's Rule of Five, heptyl cyano(3-{4-[(E)-2-phenylethenyl]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-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate?
The CAS number of heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate is 585561-35-9.
What is the molecular formula of heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate?
The molecular formula of heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate is C30H35N5O2.
What is the molecular weight of heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate?
The molecular weight of heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate is 497.28 g/mol.
Where can I buy heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate?
You can request a quote for heptyl cyano(3-{4-[(E)-2-phenylethenyl]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-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for heptyl cyano(3-{4-[(E)-2-phenylethenyl]piperazin-1-yl}quinoxalin-2-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.