ethyl 6-({[4-(difluoromethyl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-1-ethyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-({[4-(difluoromethyl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-1-ethyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-({[4-(difluoromethyl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-1-ethyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | Y503-3809 |
| Compound Name: | ethyl 6-({[4-(difluoromethyl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-1-ethyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 462.52 |
| Molecular Formula: | C22 H24 F2 N4 O3 S |
| Smiles: | CCN1C(CSc2nc(C)cc(C(F)F)n2)=C(C(c2ccccc2)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9544 |
| logD: | 3.9524 |
| logSw: | -3.8251 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.577 |
| InChI Key: | LCZCWRVCJSMJPP-GOSISDBHSA-N |