ethyl 1-methyl-4-(3-nitrophenyl)-2-oxo-6-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-methyl-4-(3-nitrophenyl)-2-oxo-6-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-methyl-4-(3-nitrophenyl)-2-oxo-6-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8012-2707 |
| Compound Name: | ethyl 1-methyl-4-(3-nitrophenyl)-2-oxo-6-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C17 H21 N3 O5 |
| Smiles: | CCCC1=C(C(c2cccc(c2)[N+]([O-])=O)NC(N1C)=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.97 |
| logD: | 2.9226 |
| logSw: | -3.311 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.172 |
| InChI Key: | PMCGKMXYGYODTJ-HNNXBMFYSA-N |