ethyl 4-(1-ethyl-1H-pyrazol-4-yl)-2-oxo-6-({[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(1-ethyl-1H-pyrazol-4-yl)-2-oxo-6-({[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(1-ethyl-1H-pyrazol-4-yl)-2-oxo-6-({[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | Y503-3678 |
| Compound Name: | ethyl 4-(1-ethyl-1H-pyrazol-4-yl)-2-oxo-6-({[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 456.44 |
| Molecular Formula: | C18 H19 F3 N6 O3 S |
| Smiles: | CCn1cc(cn1)C1C(=C(CSc2nccc(C(F)(F)F)n2)NC(N1)=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9314 |
| logD: | 1.7604 |
| logSw: | -2.483 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.008 |
| InChI Key: | CHRVZWDQQXWMNT-CQSZACIVSA-N |