Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate
TL;DR: Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate (CAS 840495-93-4) is a chemical compound with molecular formula C22H26N4O2 and molecular weight 378.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl 2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)acetate
Also Known As: cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate, cyclohexyl 2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)acetate, cyclohexyl 2-cyano-2-(3-(piperidin-1-yl)quinoxalin-2-yl)acetate, CYCLOHEXYL 2-CYANO-2-[3-(PIPERIDIN-1-YL)QUINOXALIN-2-YL]ACETATE
| Molecular Formula | C22H26N4O2 |
|---|---|
| Molecular Weight | 378.21 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 79.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.20557 |
| Heavy Atoms | 28 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 840495-93-4 |
|---|---|
| SMILES | C1CCC(CC1)OC(=O)C(C#N)C2=NC3=CC=CC=C3N=C2N4CCCCC4 |
| InChIKey | VKHLNGZODADABB-UHFFFAOYSA-N |
Product Overview
Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate (CAS 840495-93-4), with molecular formula C22H26N4O2 and molecular weight 378.21 g/mol. IUPAC: cyclohexyl 2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)acetate.
Chemical Property Profile of Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate
Property Insights of Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate
The XLogP value of 4.1 indicates that Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate. Following Lipinski's Rule of Five, Cyclohexyl cyano[3-(piperidin-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 Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate?
The CAS number of Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate is 840495-93-4.
What is the molecular formula of Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate?
The molecular formula of Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate is C22H26N4O2.
What is the molecular weight of Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate?
The molecular weight of Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate is 378.21 g/mol.
Where can I buy Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate?
You can request a quote for Cyclohexyl cyano[3-(piperidin-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 Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexyl cyano[3-(piperidin-1-yl)quinoxalin-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.