![3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile structure](/static/products/1025/1025300-50-8.webp)
3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile
TL;DR: 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile (CAS 1025300-50-8) is a chemical compound with molecular formula C17H14F2N2O2S and molecular weight 348.0744 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2,4-difluorophenyl)methylamino]-2-(4-methylphenyl)sulfonylprop-2-enenitrile
Also Known As: 3-(((2,4-DIFLUOROPHENYL)METHYL)AMINO)-2-((4-METHYLPHENYL)SULFONYL)PROP-2-ENENITRILE, 3-[(2,4-difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile, 3-[(2,4-difluorophenyl)methylamino]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile, 3-[(2,4-difluorophenyl)methylamino]-2-(4-methylphenyl)sulfonylprop-2-enenitrile
Technical Specifications
| Molecular Formula | C17H14F2N2O2S |
| Molecular Weight | 348.0744 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 78.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.0744 Da |
| Heavy Atoms | 24 |
| Complexity | 598.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(=CNCC2=C(C=C(C=C2)F)F)C#N |
| InChIKey | GTQXCIPJENAICN-UHFFFAOYSA-N |
Chemical Property Profile of 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile
Property Insights of 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile
The XLogP value of 3.3 indicates that 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile. Following Lipinski's Rule of Five, 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile?
The CAS number of 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile is 1025300-50-8.
What is the molecular formula of 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile?
The molecular formula of 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile is C17H14F2N2O2S.
What is the molecular weight of 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile?
The molecular weight of 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile is 348.0744 g/mol.
Where can I buy 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile?
You can request a quote for 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile?
Yes, CoreyChem provides custom synthesis services for 3-[(2,4-Difluorophenyl)methylamino]-2-(p-tolylsulfonyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.