N-{[4-(dimethylamino)phenyl]methyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-{[4-(dimethylamino)phenyl]methyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E958-0201 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
| Molecular Weight: | 410.54 |
| Molecular Formula: | C21 H26 N6 O S |
| Smiles: | CN(C)c1ccc(CNC(C2CCN(CC2)c2nnc(n3cccc3)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0027 |
| logD: | 2.9873 |
| logSw: | -3.1818 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.029 |
| InChI Key: | CQTGPQYEYYLLRH-UHFFFAOYSA-N |