![(E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide structure](/static/products/5544/554441-92-8.webp)
(E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide
TL;DR: (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide (CAS 554441-92-8) is a chemical compound with molecular formula C19H14F4N2O3S and molecular weight 426.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide
Also Known As: (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide, 2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-{4-[(difluoromethyl)sulfanyl]phenyl}prop-2-enamide
| Molecular Formula | C19H14F4N2O3S |
|---|---|
| Molecular Weight | 426.07 g/mol |
| LogP | 5.15698 |
| Topological Polar Surface Area | 71.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 426.06613 |
| Heavy Atoms | 29 |
| Complexity | 928.04175 |
Chemical Identifiers
| CAS Number | 554441-92-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)SC(F)F)OC(F)F |
Product Overview
(E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide (CAS 554441-92-8), with molecular formula C19H14F4N2O3S and molecular weight 426.07 g/mol. IUPAC: (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide.
Chemical Property Profile of (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide
Property Insights of (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide
The XLogP value of 5.15698 indicates that (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.35 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide. Following Lipinski's Rule of Five, (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide 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 (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide?
The CAS number of (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide is 554441-92-8.
What is the molecular formula of (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide?
The molecular formula of (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide is C19H14F4N2O3S.
What is the molecular weight of (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide?
The molecular weight of (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide is 426.07 g/mol.
Where can I buy (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide?
You can request a quote for (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)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 (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-cyano-3-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[4-(difluoromethylsulfanyl)phenyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.