![Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate structure](/static/products/842/842972-05-8.png)
Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
TL;DR: Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate (CAS 842972-05-8) is a chemical compound with molecular formula C24H32N4O2 and molecular weight 408.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptyl 2-cyano-2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
Also Known As: heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate, Heptyl 2-cyano-2-[3-(3-methyl-1-piperidyl)quinoxalin-2-yl]acetate, Heptyl I+/--cyano-3-(3-methyl-1-piperidinyl)-2-quinoxalineacetate, heptyl 2-cyano-2-(3-(3-methylpiperidin-1-yl)quinoxalin-2-yl)acetate, heptyl 2-cyano-2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
| Molecular Formula | C24H32N4O2 |
|---|---|
| Molecular Weight | 408.25 g/mol |
| LogP | 4.98688 |
| Topological Polar Surface Area | 79.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 408.25253 |
| Heavy Atoms | 30 |
| Complexity | 892.3952 |
Chemical Identifiers
| CAS Number | 842972-05-8 |
|---|---|
| SMILES | CCCCCCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCC(C3)C |
Product Overview
Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate (CAS 842972-05-8), with molecular formula C24H32N4O2 and molecular weight 408.25 g/mol. IUPAC: heptyl 2-cyano-2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate.
Chemical Property Profile of Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
Property Insights of Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
The XLogP value of 4.98688 indicates that Heptyl cyano[3-(3-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 Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate. Following Lipinski's Rule of Five, Heptyl cyano[3-(3-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 Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
The CAS number of Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate is 842972-05-8.
What is the molecular formula of Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
The molecular formula of Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate is C24H32N4O2.
What is the molecular weight of Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
The molecular weight of Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate is 408.25 g/mol.
Where can I buy Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
You can request a quote for Heptyl cyano[3-(3-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 Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Heptyl cyano[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.