N-[4-fluoro-3-(trifluoromethyl)phenyl]-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[4-fluoro-3-(trifluoromethyl)phenyl]-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxamide
N-[4-fluoro-3-(trifluoromethyl)phenyl]-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Compound characteristics
Compound ID: | E200-0053 |
Compound Name: | N-[4-fluoro-3-(trifluoromethyl)phenyl]-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxamide |
Molecular Weight: | 393.3 |
Molecular Formula: | C18 H11 F4 N3 O3 |
Smiles: | C1=C(C(Nc2ccc(c(c2)C(F)(F)F)F)=O)C(N(C(N1)=O)c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 3.0891 |
logD: | 0.197 |
logSw: | -3.7011 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 62.849 |
InChI Key: | YKQOKDINWHITCS-UHFFFAOYSA-N |