{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(phenyl)methanone
{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | S564-0279 |
| Compound Name: | {4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(phenyl)methanone |
| Molecular Weight: | 298.39 |
| Molecular Formula: | C17 H22 N4 O |
| Smiles: | CCc1nnc(CC2CCN(CC2)C(c2ccccc2)=O)[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.1162 |
| logD: | 2.1094 |
| logSw: | -2.5101 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.653 |
| InChI Key: | UIEOTNGUBQGXAR-UHFFFAOYSA-N |