3-{6-[4-(3-methoxyphenyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazin-3-yl}-1-(4-phenylpiperazin-1-yl)propan-1-one
Chemical Structure Depiction of
3-{6-[4-(3-methoxyphenyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazin-3-yl}-1-(4-phenylpiperazin-1-yl)propan-1-one
3-{6-[4-(3-methoxyphenyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazin-3-yl}-1-(4-phenylpiperazin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | E591-0035 |
| Compound Name: | 3-{6-[4-(3-methoxyphenyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazin-3-yl}-1-(4-phenylpiperazin-1-yl)propan-1-one |
| Molecular Weight: | 526.64 |
| Molecular Formula: | C29 H34 N8 O2 |
| Smiles: | COc1cccc(c1)N1CCN(CC1)c1ccc2nnc(CCC(N3CCN(CC3)c3ccccc3)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1099 |
| logD: | 3.1098 |
| logSw: | -3.3339 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 66.746 |
| InChI Key: | JGBRSQINIOEAIR-UHFFFAOYSA-N |