1-methyl-4-(thiomorpholin-4-yl)-N-[3-(trifluoromethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
1-methyl-4-(thiomorpholin-4-yl)-N-[3-(trifluoromethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
1-methyl-4-(thiomorpholin-4-yl)-N-[3-(trifluoromethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | P857-0862 |
| Compound Name: | 1-methyl-4-(thiomorpholin-4-yl)-N-[3-(trifluoromethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 438.43 |
| Molecular Formula: | C18 H17 F3 N6 O2 S |
| Smiles: | Cn1c2c(cn1)c(nc(C(Nc1cccc(c1)OC(F)(F)F)=O)n2)N1CCSCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.8569 |
| logD: | 3.8569 |
| logSw: | -3.9265 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.071 |
| InChI Key: | RELLDMSNYDADKN-UHFFFAOYSA-N |