2-[8-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[8-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
2-[8-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | M451-1890 |
| Compound Name: | 2-[8-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 451.47 |
| Molecular Formula: | C20 H20 F3 N5 O2 S |
| Smiles: | C1CCC(CC1)SC1C2=NN(CC(Nc3cccc(c3)C(F)(F)F)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2305 |
| logD: | 4.2303 |
| logSw: | -4.3022 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.779 |
| InChI Key: | WYFRCQAIBWCSKX-UHFFFAOYSA-N |