3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-1-one
Chemical Structure Depiction of
3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-1-one
3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-1-one
Compound characteristics
| Compound ID: | G395-1051 |
| Compound Name: | 3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-1-one |
| Molecular Weight: | 443.51 |
| Molecular Formula: | C23 H25 N9 O |
| Smiles: | C(Cc1nnc2ccc(NCc3cccnc3)nn12)C(N1CCN(CC1)c1ccccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8033 |
| logD: | 0.7741 |
| logSw: | -0.9474 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.857 |
| InChI Key: | XIEOHMKXXJOXSJ-UHFFFAOYSA-N |