2-cyano-3-(4-ethylanilino)-3-{[(3-nitrophenyl)methyl]sulfanyl}prop-2-enamide

Chemical Structure Depiction of
2-cyano-3-(4-ethylanilino)-3-{[(3-nitrophenyl)methyl]sulfanyl}prop-2-enamide
Available: 197 mg
Amount:
mg
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Compound characteristics

Compound ID: K291-0094
Compound Name: 2-cyano-3-(4-ethylanilino)-3-{[(3-nitrophenyl)methyl]sulfanyl}prop-2-enamide
Molecular Weight: 382.44
Molecular Formula: C19 H18 N4 O3 S
Smiles: CCc1ccc(cc1)N/C(=C(/C#N)C(N)=O)SCc1cccc(c1)[N+]([O-])=O
Stereo: ACHIRAL
logP: 3.8788
logD: 3.876
logSw: -4.0255
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 3
Polar surface area: 94.427
InChI Key: LFVVYIXVBQQAIG-UHFFFAOYSA-N
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