6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-phenyl[1,2,4]triazolo[4,3-b]pyridazine
Chemical Structure Depiction of
6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-phenyl[1,2,4]triazolo[4,3-b]pyridazine
6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-phenyl[1,2,4]triazolo[4,3-b]pyridazine
Compound characteristics
| Compound ID: | 8016-7907 |
| Compound Name: | 6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-phenyl[1,2,4]triazolo[4,3-b]pyridazine |
| Molecular Weight: | 414.47 |
| Molecular Formula: | C23 H22 N6 O2 |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)c1ccc2nnc(c3ccccc3)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4523 |
| logD: | 2.7279 |
| logSw: | -3.5513 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.969 |
| InChI Key: | RKQOKTDPFSZVCL-UHFFFAOYSA-N |