4-{3-[5-(4-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enamido}phenyl thiocyanate

Chemical Structure Depiction of
4-{3-[5-(4-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enamido}phenyl thiocyanate
Available: 2 mg
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mg
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Compound characteristics

Compound ID: 8013-4552
Compound Name: 4-{3-[5-(4-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enamido}phenyl thiocyanate
Molecular Weight: 405.86
Molecular Formula: C21 H12 Cl N3 O2 S
Smiles: C(=C(/C#N)C(Nc1ccc(cc1)SC#N)=O)/c1ccc(c2ccc(cc2)[Cl])o1
Stereo: ACHIRAL
logP: 5.5603
logD: 5.5512
logSw: -6.1461
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 65.752
InChI Key: LOJIUQFCTSDZAR-UHFFFAOYSA-N
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