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2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide structure
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2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide

TL;DR: 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide (CAS 473884-58-1) is a chemical compound with molecular formula C18H14F2N2O3S and molecular weight 376.0693 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(E)-2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide

Also Known As: 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide, (E)-2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide

CAS Number
473884-58-1
Molecular Formula
C18H14F2N2O3S
Molecular Weight
376.0693 g/mol
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Technical Specifications

Molecular FormulaC18H14F2N2O3S
Molecular Weight376.0693 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)108.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds6
Exact Mass376.0693 Da
Heavy Atoms26
Complexity556.0
SMILESCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)SC(F)F)O
InChIKeyGUFNZVQWFQWJPG-XYOKQWHBSA-N

Chemical Property Profile of 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide

XLogP
4.7
TPSA (Topological Polar Surface Area)
108.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
6
Heavy Atoms
26
Complexity
556.0
Exact Mass
376.0693
Monoisotopic Mass
376.0693
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide

The XLogP value of 4.7 indicates that 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide?

The CAS number of 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide is 473884-58-1.

What is the molecular formula of 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide?

The molecular formula of 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide is C18H14F2N2O3S.

What is the molecular weight of 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide?

The molecular weight of 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide is 376.0693 g/mol.

Where can I buy 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide?

You can request a quote for 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide?

Yes, CoreyChem provides custom synthesis services for 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-(3-hydroxy-4-methoxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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