2-(methylsulfanyl)ethyl 1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2-(methylsulfanyl)ethyl 1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2-(methylsulfanyl)ethyl 1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8014-7704 |
| Compound Name: | 2-(methylsulfanyl)ethyl 1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 388.41 |
| Molecular Formula: | C17 H19 F3 N2 O3 S |
| Smiles: | CC1=C(C(c2ccc(cc2)C(F)(F)F)NC(N1C)=O)C(=O)OCCSC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9324 |
| logD: | 2.9295 |
| logSw: | -3.3286 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.723 |
| InChI Key: | WZISHJCKJPDOSZ-AWEZNQCLSA-N |