3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(phenylmethanesulfonyl)piperidine
Chemical Structure Depiction of
3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(phenylmethanesulfonyl)piperidine
3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(phenylmethanesulfonyl)piperidine
Compound characteristics
| Compound ID: | T501-0700 |
| Compound Name: | 3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(phenylmethanesulfonyl)piperidine |
| Molecular Weight: | 410.54 |
| Molecular Formula: | C22 H26 N4 O2 S |
| Smiles: | C1CC(Cc2nncn2Cc2ccccc2)CN(C1)S(Cc1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6258 |
| logD: | 2.6257 |
| logSw: | -2.937 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.838 |
| InChI Key: | PCMYUSQVMMRIII-OAQYLSRUSA-N |