(2H-1,3-benzodioxol-5-yl)[4-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl)[4-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
(2H-1,3-benzodioxol-5-yl)[4-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
Compound characteristics
| Compound ID: | T630-2521 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl)[4-(5-cyclopropyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone |
| Molecular Weight: | 340.38 |
| Molecular Formula: | C18 H20 N4 O3 |
| Smiles: | C1CN(CCC1c1nnc(C2CC2)[nH]1)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5706 |
| logD: | 1.5528 |
| logSw: | -2.1171 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.039 |
| InChI Key: | QDGFWOYKUZOBEL-UHFFFAOYSA-N |