N-[(4-methylphenyl)methyl]-4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide
N-[(4-methylphenyl)methyl]-4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S517-0670 |
| Compound Name: | N-[(4-methylphenyl)methyl]-4-{[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)n1cnnc1CC1CCN(CC1)C(NCc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7063 |
| logD: | 2.6934 |
| logSw: | -2.9425 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.153 |
| InChI Key: | ISZNJTNADWEJBA-UHFFFAOYSA-N |