2-[6-(tert-butylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3,4-difluorophenyl)acetamide
Chemical Structure Depiction of
2-[6-(tert-butylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3,4-difluorophenyl)acetamide
2-[6-(tert-butylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3,4-difluorophenyl)acetamide
Compound characteristics
| Compound ID: | F804-1045 |
| Compound Name: | 2-[6-(tert-butylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3,4-difluorophenyl)acetamide |
| Molecular Weight: | 393.41 |
| Molecular Formula: | C17 H17 F2 N5 O2 S |
| Smiles: | CC(C)(C)SC1C=CC2=NN(CC(Nc3ccc(c(c3)F)F)=O)C(N2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7149 |
| logD: | 3.712 |
| logSw: | -3.9594 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.597 |
| InChI Key: | AKPSUADRCZCCHR-UHFFFAOYSA-N |