ethyl 9-methyl-2-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Chemical Structure Depiction of
ethyl 9-methyl-2-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
ethyl 9-methyl-2-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Compound characteristics
| Compound ID: | Y502-2188 |
| Compound Name: | ethyl 9-methyl-2-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate |
| Molecular Weight: | 410.38 |
| Molecular Formula: | C16 H13 F3 N6 O2 S |
| Smiles: | CCOC(c1c(C)c2c3nc(c4cc(C(F)(F)F)n(C)n4)nn3cnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0795 |
| logD: | 3.0779 |
| logSw: | -3.2188 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.389 |
| InChI Key: | ADTNKWXORWHFNH-UHFFFAOYSA-N |