N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-3-[6-(piperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Chemical Structure Depiction of
N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-3-[6-(piperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-3-[6-(piperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Compound characteristics
| Compound ID: | E591-0885 |
| Compound Name: | N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-3-[6-(piperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide |
| Molecular Weight: | 489.66 |
| Molecular Formula: | C28 H39 N7 O |
| Smiles: | Cc1ccc(C)c(CN2CCC(CC2)CNC(CCc2nnc3ccc(nn23)N2CCCCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8663 |
| logD: | 1.5891 |
| logSw: | -3.8113 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.493 |
| InChI Key: | PKJOZGYSNJSCPQ-UHFFFAOYSA-N |