(2H-1,3-benzodioxol-5-yl)[4-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl)[4-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
(2H-1,3-benzodioxol-5-yl)[4-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
Compound characteristics
| Compound ID: | T632-1772 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl)[4-(4-ethyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone |
| Molecular Weight: | 328.37 |
| Molecular Formula: | C17 H20 N4 O3 |
| Smiles: | CCn1cnnc1C1CCN(CC1)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0887 |
| logD: | 1.0885 |
| logSw: | -2.0163 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.083 |
| InChI Key: | PZKXRCIIEBZQQX-UHFFFAOYSA-N |