2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene
TL;DR: 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene (CAS 1024790-72-4) is a chemical compound with molecular formula C15H13FN2O4S and molecular weight 336.058 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-fluoro-N-[2-(4-methylphenyl)sulfonyl-2-nitroethenyl]aniline
Also Known As: 4-fluoro-N-[2-nitro-2-(p-tolylsulfonyl)vinyl]aniline, 2-((4-FLUOROPHENYL)AMINO)-1-((4-METHYLPHENYL)SULFONYL)-1-NITROETHENE, 4-fluoro-N-[2-(4-methylphenyl)sulfonyl-2-nitroethenyl]aniline, 4-fluoro-N-[2-(4-methylphenyl)sulfonyl-2-nitro-ethenyl]aniline
Technical Specifications
| Molecular Formula | C15H13FN2O4S |
| Molecular Weight | 336.058 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.058 Da |
| Heavy Atoms | 23 |
| Complexity | 537.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC=C(C=C2)F)[N+](=O)[O-] |
| InChIKey | ZZKQBVPHTDTSET-UHFFFAOYSA-N |
Chemical Property Profile of 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene
Property Insights of 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene
The XLogP value of 3.9 indicates that 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene. Following Lipinski's Rule of Five, 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene 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 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene?
The CAS number of 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene is 1024790-72-4.
What is the molecular formula of 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene?
The molecular formula of 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene is C15H13FN2O4S.
What is the molecular weight of 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene?
The molecular weight of 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene is 336.058 g/mol.
Where can I buy 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene?
You can request a quote for 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene?
Yes, CoreyChem provides custom synthesis services for 2-((4-Fluorophenyl)amino)-1-((4-methylphenyl)sulfonyl)-1-nitroethene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.