N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[6-(4-methylpiperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[6-(4-methylpiperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[6-(4-methylpiperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Compound characteristics
| Compound ID: | E591-0163 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[6-(4-methylpiperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide |
| Molecular Weight: | 422.49 |
| Molecular Formula: | C22 H26 N6 O3 |
| Smiles: | CC1CCN(CC1)c1ccc2nnc(CCC(NCc3ccc4c(c3)OCO4)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.382 |
| logD: | 2.382 |
| logSw: | -2.8509 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.876 |
| InChI Key: | WGRCQPBQUXLJQB-UHFFFAOYSA-N |