1-{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxyethan-1-one
Chemical Structure Depiction of
1-{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxyethan-1-one
1-{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxyethan-1-one
Compound characteristics
| Compound ID: | S517-0063 |
| Compound Name: | 1-{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxyethan-1-one |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | Cn1cnnc1CC1CCN(CC1)C(COc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1394 |
| logD: | 1.1381 |
| logSw: | -1.5806 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.747 |
| InChI Key: | HZMFAZUJBPIUEE-UHFFFAOYSA-N |