propan-2-yl 6-methyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
propan-2-yl 6-methyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
propan-2-yl 6-methyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 8011-5539 |
Compound Name: | propan-2-yl 6-methyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 342.32 |
Molecular Formula: | C16 H17 F3 N2 O3 |
Smiles: | CC(C)OC(C1C(c2ccc(cc2)C(F)(F)F)NC(NC=1C)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8633 |
logD: | 2.7131 |
logSw: | -3.2822 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.124 |
InChI Key: | BGCSYYDMZFQONT-ZDUSSCGKSA-N |