![(2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile structure](/static/products/903/903867-59-4.png)
(2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile
TL;DR: (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile (CAS 903867-59-4) is a chemical compound with molecular formula C15H19N3O2S and molecular weight 305.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-(4-methylphenyl)sulfonyl-3-(4-methylpiperazin-1-yl)prop-2-enenitrile
Also Known As: (E)-3-(4-methylpiperazin-1-yl)-2-tosylacrylonitrile, (E)-2-(4-methylphenyl)sulfonyl-3-(4-methylpiperazin-1-yl)prop-2-enenitrile, (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile
| Molecular Formula | C15H19N3O2S |
|---|---|
| Molecular Weight | 305.12 g/mol |
| LogP | 1.3811 |
| Topological Polar Surface Area | 64.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.1198 |
| Heavy Atoms | 21 |
| Complexity | 663.8654 |
Chemical Identifiers
| CAS Number | 903867-59-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)/C(=C/N2CCN(CC2)C)/C#N |
Product Overview
(2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile (CAS 903867-59-4), with molecular formula C15H19N3O2S and molecular weight 305.12 g/mol. IUPAC: (E)-2-(4-methylphenyl)sulfonyl-3-(4-methylpiperazin-1-yl)prop-2-enenitrile.
Chemical Property Profile of (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile
Property Insights of (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile
The XLogP value of 1.3811 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile. The TPSA of 64.41 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile. Following Lipinski's Rule of Five, (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 5 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 (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile?
The CAS number of (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile is 903867-59-4.
What is the molecular formula of (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile?
The molecular formula of (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile is C15H19N3O2S.
What is the molecular weight of (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile?
The molecular weight of (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile is 305.12 g/mol.
Where can I buy (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile?
You can request a quote for (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[(4-methylphenyl)sulfonyl]-3-(4-methylpiperazin-1-yl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.