2-methyl-4-(thiomorpholin-4-yl)-N-{[4-(trifluoromethyl)phenyl]methyl}-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-methyl-4-(thiomorpholin-4-yl)-N-{[4-(trifluoromethyl)phenyl]methyl}-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
2-methyl-4-(thiomorpholin-4-yl)-N-{[4-(trifluoromethyl)phenyl]methyl}-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | T491-0523 |
| Compound Name: | 2-methyl-4-(thiomorpholin-4-yl)-N-{[4-(trifluoromethyl)phenyl]methyl}-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 436.46 |
| Molecular Formula: | C19 H19 F3 N6 O S |
| Smiles: | Cn1cc2c(nc(C(NCc3ccc(cc3)C(F)(F)F)=O)nc2n1)N1CCSCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.015 |
| logD: | 3.015 |
| logSw: | -3.2496 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.235 |
| InChI Key: | PEBJLTJZNMCXIJ-UHFFFAOYSA-N |