2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile
TL;DR: 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile (CAS 797764-99-9) is a chemical compound with molecular formula C23H24N4O2S and molecular weight 420.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenyl)sulfonyl-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetonitrile
Also Known As: 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile, 2-(4-methylphenyl)sulfonyl-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetonitrile, 2-[3-(4-methylpiperidino)quinoxalin-2-yl]-2-tosyl-acetonitrile, [(4-methylphenyl)sulfonyl][3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetonitrile, 2-(4-methylphenyl)sulfonyl-2-[3-(4-methyl-1-piperidinyl)-2-quinoxalinyl]acetonitrile
| Molecular Formula | C23H24N4O2S |
|---|---|
| Molecular Weight | 420.16 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 95.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.162 |
| Heavy Atoms | 30 |
| Complexity | 726.0 |
Chemical Identifiers
| CAS Number | 797764-99-9 |
|---|---|
| SMILES | CC1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=C(C=C4)C |
| InChIKey | XVCAIZBMSLPKTC-UHFFFAOYSA-N |
Product Overview
2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile (CAS 797764-99-9), with molecular formula C23H24N4O2S and molecular weight 420.16 g/mol. IUPAC: 2-(4-methylphenyl)sulfonyl-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetonitrile.
Chemical Property Profile of 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile
Property Insights of 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile
The XLogP value of 4.1 indicates that 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile. Following Lipinski's Rule of Five, 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile 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 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile?
The CAS number of 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile is 797764-99-9.
What is the molecular formula of 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile?
The molecular formula of 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile is C23H24N4O2S.
What is the molecular weight of 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile?
The molecular weight of 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile is 420.16 g/mol.
Where can I buy 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile?
You can request a quote for 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-(4-methylpiperidin-1-yl)quinoxalin-2-yl)-2-tosylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.