3-phenyl-1-(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-phenyl-1-(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one
3-phenyl-1-(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S564-0767 |
| Compound Name: | 3-phenyl-1-(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C22 H25 N5 O |
| Smiles: | C1CN(CCC1Cc1nnc(c2ccncc2)[nH]1)C(CCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8196 |
| logD: | 2.7962 |
| logSw: | -3.0979 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.291 |
| InChI Key: | SUOLYHYCHNDFDG-UHFFFAOYSA-N |