1-{4-methyl-2-[3-(trifluoromethyl)anilino]pyrimidin-5-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-methyl-2-[3-(trifluoromethyl)anilino]pyrimidin-5-yl}ethan-1-one
1-{4-methyl-2-[3-(trifluoromethyl)anilino]pyrimidin-5-yl}ethan-1-one
Compound characteristics
| Compound ID: | Y021-2032 |
| Compound Name: | 1-{4-methyl-2-[3-(trifluoromethyl)anilino]pyrimidin-5-yl}ethan-1-one |
| Molecular Weight: | 295.26 |
| Molecular Formula: | C14 H12 F3 N3 O |
| Smiles: | CC(c1cnc(Nc2cccc(c2)C(F)(F)F)nc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3716 |
| logD: | 3.3716 |
| logSw: | -3.7261 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.782 |
| InChI Key: | GMXRKGFKSKNWNL-UHFFFAOYSA-N |