N-(2-phenylethyl)-3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide
Chemical Structure Depiction of
N-(2-phenylethyl)-3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide
N-(2-phenylethyl)-3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide
Compound characteristics
| Compound ID: | T501-0407 |
| Compound Name: | N-(2-phenylethyl)-3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide |
| Molecular Weight: | 355.48 |
| Molecular Formula: | C20 H29 N5 O |
| Smiles: | CC(C)n1cnnc1CC1CCCN(C1)C(NCCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6649 |
| logD: | 2.6644 |
| logSw: | -3.0028 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.928 |
| InChI Key: | PDTWBYRYRDKBCT-GOSISDBHSA-N |