2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile
TL;DR: 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile (CAS 1025276-52-1) is a chemical compound with molecular formula C11H11ClN2O2S2 and molecular weight 301.99506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanylprop-2-enenitrile
Also Known As: 2-((4-CHLOROPHENYL)SULFONYL)-3-(METHYLAMINO)-3-METHYLTHIOPROP-2-ENENITRILE, 2-(4-chlorophenyl)sulfonyl-3-methylamino-3-methylsulfanyl-prop-2-enenitrile, (Z)-2-[(4-chlorophenyl)sulfonyl]-3-(methylamino)-3-(methylsulfanyl)-2-propenenitrile, 2-(4-chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile, 2-(4-chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanylprop-2-enenitrile
Technical Specifications
| Molecular Formula | C11H11ClN2O2S2 |
| Molecular Weight | 301.99506 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.99506 Da |
| Heavy Atoms | 18 |
| Complexity | 465.0 |
| SMILES | CNC(=C(C#N)S(=O)(=O)C1=CC=C(C=C1)Cl)SC |
| InChIKey | HEVRSDFPYFAVMI-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile
Property Insights of 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile. Following Lipinski's Rule of Five, 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile?
The CAS number of 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile is 1025276-52-1.
What is the molecular formula of 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile?
The molecular formula of 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile is C11H11ClN2O2S2.
What is the molecular weight of 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile?
The molecular weight of 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile is 301.99506 g/mol.
Where can I buy 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile?
You can request a quote for 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile?
Yes, CoreyChem provides custom synthesis services for 2-(4-Chlorophenyl)sulfonyl-3-(methylamino)-3-methylsulfanyl-prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.