N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-[6-(4-methylpiperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Chemical Structure Depiction of
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-[6-(4-methylpiperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-[6-(4-methylpiperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Compound characteristics
| Compound ID: | E591-0251 |
| Compound Name: | N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-[6-(4-methylpiperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide |
| Molecular Weight: | 450.54 |
| Molecular Formula: | C24 H30 N6 O3 |
| Smiles: | CC1CCN(CC1)c1ccc2nnc(CCC(NC(C)c3ccc4c(c3)OCCO4)=O)n2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0936 |
| logD: | 2.0936 |
| logSw: | -2.8456 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.747 |
| InChI Key: | YEGNVTWXKWFRMM-KRWDZBQOSA-N |