9-ethyl-2-{1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-2-yl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
9-ethyl-2-{1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-2-yl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
9-ethyl-2-{1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-2-yl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-8025 |
| Compound Name: | 9-ethyl-2-{1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-2-yl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 448.51 |
| Molecular Formula: | C21 H23 F3 N6 S |
| Smiles: | CCC1CCc2c3c4nc(C(C)Cn5c(C)cc(C(F)(F)F)n5)nn4C=Nc3sc2C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7393 |
| logD: | 4.7391 |
| logSw: | -4.7189 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 47.777 |
| InChI Key: | BVUZSBSAIMTGHV-UHFFFAOYSA-N |