3,4,5-trimethoxy-N-[4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]benzamide
Chemical Structure Depiction of
3,4,5-trimethoxy-N-[4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]benzamide
3,4,5-trimethoxy-N-[4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]benzamide
Compound characteristics
| Compound ID: | C202-2219 |
| Compound Name: | 3,4,5-trimethoxy-N-[4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]benzamide |
| Molecular Weight: | 428.4 |
| Molecular Formula: | C20 H20 N4 O7 |
| Smiles: | COc1cc(cc(c1OC)OC)C(NC1NC(CC(c2cccc(c2)[N+]([O-])=O)N=1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9656 |
| logD: | 1.9644 |
| logSw: | -2.8044 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.593 |
| InChI Key: | HSBBEDIINCIJKB-AWEZNQCLSA-N |