4-{[3-(4-benzyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methyl}benzonitrile
Chemical Structure Depiction of
4-{[3-(4-benzyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methyl}benzonitrile
4-{[3-(4-benzyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methyl}benzonitrile
Compound characteristics
| Compound ID: | T633-0489 |
| Compound Name: | 4-{[3-(4-benzyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methyl}benzonitrile |
| Molecular Weight: | 357.46 |
| Molecular Formula: | C22 H23 N5 |
| Smiles: | C1CC(CN(C1)Cc1ccc(C#N)cc1)c1nncn1Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6518 |
| logD: | 2.3133 |
| logSw: | -2.6835 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 45.045 |
| InChI Key: | SASNVZIZIVSPEY-NRFANRHFSA-N |