6-(trifluoromethyl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-(trifluoromethyl)pyrimidin-4(3H)-one
6-(trifluoromethyl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | S553-0179 |
| Compound Name: | 6-(trifluoromethyl)pyrimidin-4(3H)-one |
| Molecular Weight: | 164.08 |
| Molecular Formula: | C5 H3 F3 N2 O |
| Smiles: | C1=C(C(F)(F)F)N=CNC1=O |
| Stereo: | ACHIRAL |
| logP: | 0.2061 |
| logD: | -1.6096 |
| logSw: | -0.8669 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.235 |
| InChI Key: | LVOYSBZJJWPUBD-UHFFFAOYSA-N |