2-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
2-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | G856-6482 |
| Compound Name: | 2-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C21 H18 F N5 O S |
| Smiles: | C(CNC(CSc1nnc2ccc(c3ccc(cc3)F)nn12)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0741 |
| logD: | 3.0741 |
| logSw: | -3.4034 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.02 |
| InChI Key: | NBRYSUHXBJTUNW-UHFFFAOYSA-N |