1-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxamide
Chemical Structure Depiction of
1-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxamide
1-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxamide
Compound characteristics
Compound ID: | P491-2533 |
Compound Name: | 1-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxamide |
Molecular Weight: | 400.79 |
Molecular Formula: | C19 H14 Cl F N4 O3 |
Smiles: | C(C(Nc1ccc(cc1[Cl])F)=O)N1C(c2ccccc2)=NC=C(C(N)=O)C1=O |
Stereo: | ACHIRAL |
logP: | 1.825 |
logD: | 1.8201 |
logSw: | -2.7979 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 81.849 |
InChI Key: | XNMNBZQZVVWNCP-UHFFFAOYSA-N |