6-[(4-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[(4-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
6-[(4-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C201-2006 |
| Compound Name: | 6-[(4-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one |
| Molecular Weight: | 258.3 |
| Molecular Formula: | C12 H10 N4 O S |
| Smiles: | Cc1ccc(cc1)SC1C=CC2=NNC(N2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1108 |
| logD: | 1.6315 |
| logSw: | -3.2945 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.778 |
| InChI Key: | SVJSYMYGSKESLF-UHFFFAOYSA-N |