3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-1-(4-methylpiperidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-1-(4-methylpiperidin-1-yl)propan-1-one
3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-1-(4-methylpiperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | E591-0414 |
| Compound Name: | 3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-1-(4-methylpiperidin-1-yl)propan-1-one |
| Molecular Weight: | 371.48 |
| Molecular Formula: | C19 H29 N7 O |
| Smiles: | CC1CCN(CC1)C(CCc1nnc2ccc(nn12)N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8798 |
| logD: | 0.3087 |
| logSw: | -1.4303 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.158 |
| InChI Key: | VQEAHQLCHFLABC-UHFFFAOYSA-N |