![(E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile structure](/static/products/1025/1025264-69-0.webp)
(E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile
TL;DR: (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile (CAS 1025264-69-0) is a chemical compound with molecular formula C16H10F3NO3S and molecular weight 353.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-3-[3-(trifluoromethoxy)phenyl]prop-2-enenitrile
Also Known As: 2-(benzenesulfonyl)-3-[3-(trifluoromethoxy)phenyl]prop-2-enenitrile, (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile, (2E)-2-(benzenesulfonyl)-3-[3-(trifluoromethoxy)phenyl]prop-2-enenitrile, 2-(PHENYLSULFONYL)-3-(3-(TRIFLUOROMETHOXY)PHENYL)PROP-2-ENENITRILE
| Molecular Formula | C16H10F3NO3S |
|---|---|
| Molecular Weight | 353.03 g/mol |
| LogP | 3.92358 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.03336 |
| Heavy Atoms | 24 |
| Complexity | 898.15515 |
Chemical Identifiers
| CAS Number | 1025264-69-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=CC=C2)OC(F)(F)F)C#N |
Product Overview
(E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile (CAS 1025264-69-0), with molecular formula C16H10F3NO3S and molecular weight 353.03 g/mol. IUPAC: 2-(benzenesulfonyl)-3-[3-(trifluoromethoxy)phenyl]prop-2-enenitrile.
Chemical Property Profile of (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile
Property Insights of (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile
The XLogP value of 3.92358 indicates that (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.16 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile. Following Lipinski's Rule of Five, (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile has 0 hydrogen bond donor(s) and 4 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 (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile?
The CAS number of (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile is 1025264-69-0.
What is the molecular formula of (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile?
The molecular formula of (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile is C16H10F3NO3S.
What is the molecular weight of (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile?
The molecular weight of (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile is 353.03 g/mol.
Where can I buy (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile?
You can request a quote for (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(phenylsulfonyl)-3-[3-(trifluoromethoxy)phenyl]-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.