N-(3-chloro-4-methylphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
N-(3-chloro-4-methylphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Compound characteristics
Compound ID: | C857-0355 |
Compound Name: | N-(3-chloro-4-methylphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide |
Molecular Weight: | 401.92 |
Molecular Formula: | C19 H20 Cl N5 O S |
Smiles: | Cc1ccc(cc1[Cl])NC(C1CCCN(C1)c1nnc(n2cccc2)s1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.5966 |
logD: | 4.5955 |
logSw: | -4.6743 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.835 |
InChI Key: | IOVPQTLXXVPMKD-AWEZNQCLSA-N |