N-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Chemical Structure Depiction of
N-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
N-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Compound characteristics
| Compound ID: | E591-0503 |
| Compound Name: | N-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide |
| Molecular Weight: | 494.62 |
| Molecular Formula: | C26 H35 F N8 O |
| Smiles: | CN1CCN(CC1)c1ccc2nnc(CCC(NCC3CCN(CC3)Cc3ccc(cc3)F)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 1.5134 |
| logD: | -0.276 |
| logSw: | -2.2461 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.97 |
| InChI Key: | LTGASQSOFYDGCQ-UHFFFAOYSA-N |