ethyl 4-{5-[2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)ethenyl]furan-2-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{5-[2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)ethenyl]furan-2-yl}benzoate
ethyl 4-{5-[2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)ethenyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 3030-5321 |
| Compound Name: | ethyl 4-{5-[2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)ethenyl]furan-2-yl}benzoate |
| Molecular Weight: | 397.34 |
| Molecular Formula: | C19 H15 N3 O7 |
| Smiles: | CCOC(c1ccc(cc1)c1ccc(/C=C/C2=C(C(NC(N2)=O)=O)[N+]([O-])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5219 |
| logD: | 0.4071 |
| logSw: | -3.5856 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.731 |
| InChI Key: | WEGONPJZDJQZCN-UHFFFAOYSA-N |