![2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile structure](/static/products/1024/1024870-97-0.webp)
2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile
TL;DR: 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile (CAS 1024870-97-0) is a chemical compound with molecular formula C16H10ClF3N2O3S and molecular weight 402.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile
Also Known As: 2-((4-CHLOROPHENYL)SULFONYL)-3-((3-(TRIFLUOROMETHOXY)PHENYL)AMINO)PROP-2-ENENITRILE, 2-(4-chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile, 2-(4-chlorophenyl)sulfonyl-3-[[3-(trifluoromethoxy)phenyl]amino]prop-2-enenitrile, C16H10ClF3N2O3S
| Molecular Formula | C16H10ClF3N2O3S |
|---|---|
| Molecular Weight | 402.01 g/mol |
| LogP | 4.48938 |
| Topological Polar Surface Area | 79.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.00528 |
| Heavy Atoms | 26 |
| Complexity | 965.46985 |
Chemical Identifiers
| CAS Number | 1024870-97-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC(F)(F)F)NC=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl |
Product Overview
2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile (CAS 1024870-97-0), with molecular formula C16H10ClF3N2O3S and molecular weight 402.01 g/mol. IUPAC: 2-(4-chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile.
Chemical Property Profile of 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile
Property Insights of 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile
The XLogP value of 4.48938 indicates that 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile. Following Lipinski's Rule of Five, 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]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
Frequently Asked Questions
What is the CAS number of 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile?
The CAS number of 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile is 1024870-97-0.
What is the molecular formula of 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile?
The molecular formula of 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile is C16H10ClF3N2O3S.
What is the molecular weight of 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile?
The molecular weight of 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile is 402.01 g/mol.
Where can I buy 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile?
You can request a quote for 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]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 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorophenyl)sulfonyl-3-[3-(trifluoromethoxy)anilino]prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.