4-{3-[4-cyano-3-(trifluoromethyl)phenyl]-2,4-dioxo-1,3-diazinan-1-yl}-2-fluoro-N-methylbenzamide
Chemical Structure Depiction of
4-{3-[4-cyano-3-(trifluoromethyl)phenyl]-2,4-dioxo-1,3-diazinan-1-yl}-2-fluoro-N-methylbenzamide
4-{3-[4-cyano-3-(trifluoromethyl)phenyl]-2,4-dioxo-1,3-diazinan-1-yl}-2-fluoro-N-methylbenzamide
Compound characteristics
| Compound ID: | H030-0008 |
| Compound Name: | 4-{3-[4-cyano-3-(trifluoromethyl)phenyl]-2,4-dioxo-1,3-diazinan-1-yl}-2-fluoro-N-methylbenzamide |
| Molecular Weight: | 434.35 |
| Molecular Formula: | C20 H14 F4 N4 O3 |
| Smiles: | CNC(c1ccc(cc1F)N1CCC(N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1949 |
| logD: | 2.1949 |
| logSw: | -2.9333 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.895 |
| InChI Key: | GJCYNENVGXBQOG-UHFFFAOYSA-N |