3-methyl-7-(4-{[4-(methylsulfanyl)phenyl]methyl}piperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
Chemical Structure Depiction of
3-methyl-7-(4-{[4-(methylsulfanyl)phenyl]methyl}piperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
3-methyl-7-(4-{[4-(methylsulfanyl)phenyl]methyl}piperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
Compound characteristics
| Compound ID: | T473-1052 |
| Compound Name: | 3-methyl-7-(4-{[4-(methylsulfanyl)phenyl]methyl}piperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazine |
| Molecular Weight: | 354.48 |
| Molecular Formula: | C18 H22 N6 S |
| Smiles: | Cc1nnc2cc(cnn12)N1CCN(CC1)Cc1ccc(cc1)SC |
| Stereo: | ACHIRAL |
| logP: | 1.8237 |
| logD: | 1.7706 |
| logSw: | -1.7368 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.662 |
| InChI Key: | QASZMYXOVHIOTE-UHFFFAOYSA-N |