N-[(4-fluorophenyl)methyl]-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
N-[(4-fluorophenyl)methyl]-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Compound characteristics
| Compound ID: | E591-0444 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C20 H24 F N7 O |
| Smiles: | CN1CCN(CC1)c1ccc2nnc(CCC(NCc3ccc(cc3)F)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 0.9857 |
| logD: | 0.4146 |
| logSw: | -1.9657 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.237 |
| InChI Key: | TXDGKAYYGXCDGG-UHFFFAOYSA-N |