N-[2-(4-methylphenyl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-methylphenyl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-[2-(4-methylphenyl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C857-0090 |
| Compound Name: | N-[2-(4-methylphenyl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
| Molecular Weight: | 395.53 |
| Molecular Formula: | C21 H25 N5 O S |
| Smiles: | Cc1ccc(CCNC(C2CCN(CC2)c2nnc(n3cccc3)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5096 |
| logD: | 3.5096 |
| logSw: | -3.5146 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.065 |
| InChI Key: | GESRZICZCAFXAW-UHFFFAOYSA-N |