ethyl 1-ethyl-2-oxo-4-phenyl-6-{[(4-propoxypyrimidin-2-yl)sulfanyl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-2-oxo-4-phenyl-6-{[(4-propoxypyrimidin-2-yl)sulfanyl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-ethyl-2-oxo-4-phenyl-6-{[(4-propoxypyrimidin-2-yl)sulfanyl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | Y503-3812 |
| Compound Name: | ethyl 1-ethyl-2-oxo-4-phenyl-6-{[(4-propoxypyrimidin-2-yl)sulfanyl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C23 H28 N4 O4 S |
| Smiles: | CCCOc1ccnc(n1)SCC1=C(C(c2ccccc2)NC(N1CC)=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5474 |
| logD: | 4.5454 |
| logSw: | -4.239 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | NLURMRMUWICGBD-HXUWFJFHSA-N |