phenyl(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone
Chemical Structure Depiction of
phenyl(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone
phenyl(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone
Compound characteristics
| Compound ID: | S564-0792 |
| Compound Name: | phenyl(4-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone |
| Molecular Weight: | 347.42 |
| Molecular Formula: | C20 H21 N5 O |
| Smiles: | C1CN(CCC1Cc1nnc(c2ccncc2)[nH]1)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1265 |
| logD: | 2.1031 |
| logSw: | -2.2086 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.819 |
| InChI Key: | AAGVLAXQKKYNDJ-UHFFFAOYSA-N |