N-[2-(4-ethoxyphenyl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-ethoxyphenyl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-[2-(4-ethoxyphenyl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
Compound ID: | C857-0214 |
Compound Name: | N-[2-(4-ethoxyphenyl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
Molecular Weight: | 425.55 |
Molecular Formula: | C22 H27 N5 O2 S |
Smiles: | CCOc1ccc(CCNC(C2CCN(CC2)c2nnc(n3cccc3)s2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.4552 |
logD: | 3.4552 |
logSw: | -3.4422 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.189 |
InChI Key: | WBSPMLYPADTNFD-UHFFFAOYSA-N |