![2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide structure](/static/products/328/328110-18-5.png)
2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide
TL;DR: 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide (CAS 328110-18-5) is a chemical compound with molecular formula C18H11F5N2OS and molecular weight 398.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide
Also Known As: 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide, 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-[2-(trifluoromethyl)phenyl]prop-2-enamide
| Molecular Formula | C18H11F5N2OS |
|---|---|
| Molecular Weight | 398.05 g/mol |
| LogP | 5.56578 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.05124 |
| Heavy Atoms | 27 |
| Complexity | 885.86035 |
Chemical Identifiers
| CAS Number | 328110-18-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)SC(F)F)C(F)(F)F |
Product Overview
2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide (CAS 328110-18-5), with molecular formula C18H11F5N2OS and molecular weight 398.05 g/mol. IUPAC: 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide.
Chemical Property Profile of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide
Property Insights of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide
The XLogP value of 5.56578 indicates that 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide?
The CAS number of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide is 328110-18-5.
What is the molecular formula of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide?
The molecular formula of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide is C18H11F5N2OS.
What is the molecular weight of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide?
The molecular weight of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide is 398.05 g/mol.
Where can I buy 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide?
You can request a quote for 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.