{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(1-methyl-1H-pyrazol-5-yl)methanone
Chemical Structure Depiction of
{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(1-methyl-1H-pyrazol-5-yl)methanone
{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(1-methyl-1H-pyrazol-5-yl)methanone
Compound characteristics
| Compound ID: | S564-0295 |
| Compound Name: | {4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(1-methyl-1H-pyrazol-5-yl)methanone |
| Molecular Weight: | 302.38 |
| Molecular Formula: | C15 H22 N6 O |
| Smiles: | CCc1nnc(CC2CCN(CC2)C(c2ccnn2C)=O)[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 0.7719 |
| logD: | 0.765 |
| logSw: | -1.8252 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.303 |
| InChI Key: | JTIDOFMTKFDBFB-UHFFFAOYSA-N |