N-[2-(4-benzylpiperazin-1-yl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-benzylpiperazin-1-yl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-[2-(4-benzylpiperazin-1-yl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E958-0195 |
| Compound Name: | N-[2-(4-benzylpiperazin-1-yl)ethyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
| Molecular Weight: | 479.65 |
| Molecular Formula: | C25 H33 N7 O S |
| Smiles: | C1CN(CCC1C(NCCN1CCN(CC1)Cc1ccccc1)=O)c1nnc(n2cccc2)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.6366 |
| logD: | 2.3844 |
| logSw: | -2.8611 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.589 |
| InChI Key: | XEPTZAJJMPJTMR-UHFFFAOYSA-N |