ethyl 3-acetyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 3-acetyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 3-acetyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 4476-0142 |
| Compound Name: | ethyl 3-acetyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 347.33 |
| Molecular Formula: | C16 H17 N3 O6 |
| Smiles: | [H]N1C(C)=C(C(c2cccc(c2)[N+]([O-])=O)N(C(C)=O)C1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8856 |
| logD: | -1.1085 |
| logSw: | -2.5349 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.117 |
| InChI Key: | UMPJPEONKFXGFT-AWEZNQCLSA-N |