ethyl 1-[1-(benzylsulfanyl)-3,4,4-trichloro-2-nitrobuta-1,3-dien-1-yl]piperidine-4-carboxylate

Chemical Structure Depiction of
ethyl 1-[1-(benzylsulfanyl)-3,4,4-trichloro-2-nitrobuta-1,3-dien-1-yl]piperidine-4-carboxylate
Available: 66 mg
Amount:
mg
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Compound characteristics

Compound ID: 4872-0764
Compound Name: ethyl 1-[1-(benzylsulfanyl)-3,4,4-trichloro-2-nitrobuta-1,3-dien-1-yl]piperidine-4-carboxylate
Molecular Weight: 479.81
Molecular Formula: C19 H21 Cl3 N2 O4 S
Smiles: CCOC(C1CCN(CC1)/C(=C(/C(=C([Cl])[Cl])[Cl])[N+]([O-])=O)SCc1ccccc1)=O
Stereo: ACHIRAL
logP: 5.7077
logD: 5.7077
logSw: -5.7759
Hydrogen bond acceptors count: 8
Polar surface area: 57.053
InChI Key: VQEYKRLZMSCUBM-UHFFFAOYSA-N
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