6-{2-[3-methoxy-4-(2-methylpropoxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol
Chemical Structure Depiction of
6-{2-[3-methoxy-4-(2-methylpropoxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol
6-{2-[3-methoxy-4-(2-methylpropoxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol
Compound characteristics
| Compound ID: | 5842-8665 |
| Compound Name: | 6-{2-[3-methoxy-4-(2-methylpropoxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol |
| Molecular Weight: | 361.35 |
| Molecular Formula: | C17 H19 N3 O6 |
| Smiles: | CC(C)COc1ccc(/C=C/c2c(c(nc(n2)O)O)[N+]([O-])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5663 |
| logD: | -0.8305 |
| logSw: | -3.731 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.661 |
| InChI Key: | LUKQKODVKFUTNI-UHFFFAOYSA-N |