![2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile structure](/static/products/1024/1024738-75-7.webp)
2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile
TL;DR: 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile (CAS 1024738-75-7) is a chemical compound with molecular formula C22H15F3N2O3S and molecular weight 444.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile
Also Known As: 2-(PHENYLSULFONYL)-3-((4-(3-(TRIFLUOROMETHYL)PHENOXY)PHENYL)AMINO)PROP-2-ENENITRILE, 2-(benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile, 2-(benzenesulfonyl)-3-[[4-[3-(trifluoromethyl)phenoxy]phenyl]amino]prop-2-enenitrile, C22H15F3N2O3S
| Molecular Formula | C22H15F3N2O3S |
|---|---|
| Molecular Weight | 444.08 g/mol |
| LogP | 5.74848 |
| Topological Polar Surface Area | 79.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.07556 |
| Heavy Atoms | 31 |
| Complexity | 1231.4879 |
Chemical Identifiers
| CAS Number | 1024738-75-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC=C(C=C2)OC3=CC=CC(=C3)C(F)(F)F)C#N |
Product Overview
2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile (CAS 1024738-75-7), with molecular formula C22H15F3N2O3S and molecular weight 444.08 g/mol. IUPAC: 2-(benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile.
Chemical Property Profile of 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile
Property Insights of 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile
The XLogP value of 5.74848 indicates that 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]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-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile. Following Lipinski's Rule of Five, 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile?
The CAS number of 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile is 1024738-75-7.
What is the molecular formula of 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile?
The molecular formula of 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile is C22H15F3N2O3S.
What is the molecular weight of 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile?
The molecular weight of 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile is 444.08 g/mol.
Where can I buy 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile?
You can request a quote for 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]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-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzenesulfonyl)-3-[4-[3-(trifluoromethyl)phenoxy]anilino]prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.