6-{2-[4-(benzyloxy)-3-methoxyphenyl]ethenyl}-5-nitropyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-{2-[4-(benzyloxy)-3-methoxyphenyl]ethenyl}-5-nitropyrimidine-2,4(1H,3H)-dione
6-{2-[4-(benzyloxy)-3-methoxyphenyl]ethenyl}-5-nitropyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 3030-5363 |
| Compound Name: | 6-{2-[4-(benzyloxy)-3-methoxyphenyl]ethenyl}-5-nitropyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 395.37 |
| Molecular Formula: | C20 H17 N3 O6 |
| Smiles: | COc1cc(/C=C/C2=C(C(NC(N2)=O)=O)[N+]([O-])=O)ccc1OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0199 |
| logD: | -0.0948 |
| logSw: | -3.5517 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.352 |
| InChI Key: | CYTZBOGGTNQYHK-UHFFFAOYSA-N |