6-{2-[3-ethoxy-4-(2-methylpropoxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol
Chemical Structure Depiction of
6-{2-[3-ethoxy-4-(2-methylpropoxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol
6-{2-[3-ethoxy-4-(2-methylpropoxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol
Compound characteristics
| Compound ID: | 5842-8666 |
| Compound Name: | 6-{2-[3-ethoxy-4-(2-methylpropoxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol |
| Molecular Weight: | 375.38 |
| Molecular Formula: | C18 H21 N3 O6 |
| Smiles: | CCOc1cc(/C=C/c2c(c(nc(n2)O)O)[N+]([O-])=O)ccc1OCC(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.712 |
| logD: | -0.6848 |
| logSw: | -4.0142 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.241 |
| InChI Key: | UURLANUCCQQNIN-UHFFFAOYSA-N |