ethyl {4-bromo-2-[2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)ethenyl]phenoxy}acetate
Chemical Structure Depiction of
ethyl {4-bromo-2-[2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)ethenyl]phenoxy}acetate
ethyl {4-bromo-2-[2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)ethenyl]phenoxy}acetate
Compound characteristics
| Compound ID: | 8017-6773 |
| Compound Name: | ethyl {4-bromo-2-[2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)ethenyl]phenoxy}acetate |
| Molecular Weight: | 440.2 |
| Molecular Formula: | C16 H14 Br N3 O7 |
| Smiles: | CCOC(COc1ccc(cc1/C=C/C1=C(C(NC(N1)=O)=O)[N+]([O-])=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4617 |
| logD: | -0.653 |
| logSw: | -3.0575 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.152 |
| InChI Key: | GKTPRSDDXINVGQ-UHFFFAOYSA-N |