3-({3-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}methyl)benzonitrile
Chemical Structure Depiction of
3-({3-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}methyl)benzonitrile
3-({3-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}methyl)benzonitrile
Compound characteristics
| Compound ID: | T629-1404 |
| Compound Name: | 3-({3-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}methyl)benzonitrile |
| Molecular Weight: | 344.42 |
| Molecular Formula: | C20 H20 N6 |
| Smiles: | C1CC(CN(C1)Cc1cccc(C#N)c1)c1nnc(c2ccncc2)[nH]1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6903 |
| logD: | 1.5375 |
| logSw: | -1.5229 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.902 |
| InChI Key: | UDXMZPVUVIODBZ-SFHVURJKSA-N |