2-(benzenesulfonyl)-3-(2-chloroanilino)-3-{[(4-methylphenyl)methyl]sulfanyl}prop-2-enenitrile

Chemical Structure Depiction of
2-(benzenesulfonyl)-3-(2-chloroanilino)-3-{[(4-methylphenyl)methyl]sulfanyl}prop-2-enenitrile
Available: 175 mg
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mg
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Compound characteristics

Compound ID: C644-0161
Compound Name: 2-(benzenesulfonyl)-3-(2-chloroanilino)-3-{[(4-methylphenyl)methyl]sulfanyl}prop-2-enenitrile
Molecular Weight: 455
Molecular Formula: C23 H19 Cl N2 O2 S2
Smiles: Cc1ccc(CSC(=C(/C#N)S(c2ccccc2)(=O)=O)\Nc2ccccc2[Cl])cc1
Stereo: ACHIRAL
logP: 5.4509
logD: 5.4173
logSw: -5.9167
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 55.789
InChI Key: LJYWERKCPXQECX-UHFFFAOYSA-N
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