2-[6-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-[4-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[6-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-[4-(trifluoromethyl)phenyl]acetamide
2-[6-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-[4-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | C201-1335 |
| Compound Name: | 2-[6-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-[4-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 451.47 |
| Molecular Formula: | C20 H20 F3 N5 O2 S |
| Smiles: | C1CCC(CC1)SC1C=CC2=NN(CC(Nc3ccc(cc3)C(F)(F)F)=O)C(N2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1415 |
| logD: | 5.1415 |
| logSw: | -5.2813 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.518 |
| InChI Key: | ZLOBYBMFDONADN-UHFFFAOYSA-N |