ethyl 6-(3-nitrophenyl)-4-oxo-2-(piperidin-1-yl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-(3-nitrophenyl)-4-oxo-2-(piperidin-1-yl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate
ethyl 6-(3-nitrophenyl)-4-oxo-2-(piperidin-1-yl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | Y020-6189 |
| Compound Name: | ethyl 6-(3-nitrophenyl)-4-oxo-2-(piperidin-1-yl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 374.39 |
| Molecular Formula: | C18 H22 N4 O5 |
| Smiles: | CCOC(C1C(c2cccc(c2)[N+]([O-])=O)NC(=NC1=O)N1CCCCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1925 |
| logD: | -2.9369 |
| logSw: | -2.7589 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.804 |
| InChI Key: | RFGMMIIJMZSGAZ-UHFFFAOYSA-N |