N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}-4-(trifluoromethyl)benzamide
N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | P431-0802 |
| Compound Name: | N-{1-[5-(thiomorpholin-4-yl)pyrimidin-2-yl]-1H-pyrazol-4-yl}-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 434.44 |
| Molecular Formula: | C19 H17 F3 N6 O S |
| Smiles: | C1CSCCN1c1cnc(nc1)n1cc(cn1)NC(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.571 |
| logD: | 2.5701 |
| logSw: | -2.9194 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.681 |
| InChI Key: | XRQCTSKATRKHKA-UHFFFAOYSA-N |