6-phenyl-2-[3-(trifluoromethyl)anilino]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-phenyl-2-[3-(trifluoromethyl)anilino]pyrimidin-4(3H)-one
6-phenyl-2-[3-(trifluoromethyl)anilino]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | D306-1164 |
| Compound Name: | 6-phenyl-2-[3-(trifluoromethyl)anilino]pyrimidin-4(3H)-one |
| Molecular Weight: | 331.29 |
| Molecular Formula: | C17 H12 F3 N3 O |
| Smiles: | C1=C(c2ccccc2)N=C(NC1=O)Nc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.045 |
| logD: | 4.0421 |
| logSw: | -4.2863 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.586 |
| InChI Key: | NKINUPRRPNHKNN-UHFFFAOYSA-N |