N-[(pyridin-2-yl)methyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(pyridin-2-yl)methyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-[(pyridin-2-yl)methyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
Compound ID: | C857-0018 |
Compound Name: | N-[(pyridin-2-yl)methyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
Molecular Weight: | 368.46 |
Molecular Formula: | C18 H20 N6 O S |
Smiles: | C1CN(CCC1C(NCc1ccccn1)=O)c1nnc(n2cccc2)s1 |
Stereo: | ACHIRAL |
logP: | 2.0028 |
logD: | 2.0027 |
logSw: | -2.2277 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.767 |
InChI Key: | LWSPZCCJRKWGBG-UHFFFAOYSA-N |