N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}-2-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}-2-[3-(trifluoromethyl)phenyl]acetamide
N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}-2-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | P431-0736 |
| Compound Name: | N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}-2-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 448.47 |
| Molecular Formula: | C20 H19 F3 N6 O S |
| Smiles: | C(C(Nc1cnn(c1)c1ncc(cn1)N1CCSCC1)=O)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.3895 |
| logD: | 2.3894 |
| logSw: | -2.971 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.468 |
| InChI Key: | ZSWHUOZPLCVRHY-UHFFFAOYSA-N |