6-[2-(2,5-dimethoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol
Chemical Structure Depiction of
6-[2-(2,5-dimethoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol
6-[2-(2,5-dimethoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol
Compound characteristics
| Compound ID: | 8005-0918 |
| Compound Name: | 6-[2-(2,5-dimethoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol |
| Molecular Weight: | 319.27 |
| Molecular Formula: | C14 H13 N3 O6 |
| Smiles: | COc1ccc(c(/C=C/c2c(c(nc(n2)O)O)[N+]([O-])=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.3741 |
| logD: | -2.0227 |
| logSw: | -2.3681 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.619 |
| InChI Key: | GIMLNYJYUGGRPH-UHFFFAOYSA-N |