4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-[(4-methylphenyl)methyl]piperidine-1-carboxamide
Chemical Structure Depiction of
4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-[(4-methylphenyl)methyl]piperidine-1-carboxamide
4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-[(4-methylphenyl)methyl]piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S517-0998 |
| Compound Name: | 4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-[(4-methylphenyl)methyl]piperidine-1-carboxamide |
| Molecular Weight: | 403.53 |
| Molecular Formula: | C24 H29 N5 O |
| Smiles: | Cc1ccc(CNC(N2CCC(CC2)Cc2nncn2Cc2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3357 |
| logD: | 3.3355 |
| logSw: | -3.3848 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.091 |
| InChI Key: | CRVMCQDPQXZFTQ-UHFFFAOYSA-N |