2-{6-[(4-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl}-N-(propan-2-yl)acetamide
Chemical Structure Depiction of
2-{6-[(4-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl}-N-(propan-2-yl)acetamide
2-{6-[(4-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl}-N-(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | F804-0583 |
| Compound Name: | 2-{6-[(4-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl}-N-(propan-2-yl)acetamide |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C17 H19 N5 O2 S |
| Smiles: | CC(C)NC(CN1C(N2C(C=CC(=N2)Sc2ccc(C)cc2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9529 |
| logD: | 2.9529 |
| logSw: | -3.3814 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.894 |
| InChI Key: | UNVDTNGKNMOZKS-UHFFFAOYSA-N |