2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide

Chemical Structure Depiction of
2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide
Available: 275 mg
Amount:
mg
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Compound characteristics

Compound ID: C370-5509
Compound Name: 2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]acrylamide
Molecular Weight: 448.5
Molecular Formula: C22 H20 N6 O3 S
Smiles: C1CCC(CC1)c1nnc(NC(C(=C/c2cccn2c2ccc(cc2)[N+]([O-])=O)\C#N)=O)s1
Stereo: ACHIRAL
logP: 5.35
logD: 3.53
logSw: -6.29
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 224.33
InChI Key: ZWZZLSMCVKGMOE-UHFFFAOYSA-N
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