6-[2-(3-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol
Chemical Structure Depiction of
6-[2-(3-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol
6-[2-(3-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol
Compound characteristics
| Compound ID: | 8008-6526 |
| Compound Name: | 6-[2-(3-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol |
| Molecular Weight: | 289.24 |
| Molecular Formula: | C13 H11 N3 O5 |
| Smiles: | COc1cccc(/C=C/c2c(c(nc(n2)O)O)[N+]([O-])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.3907 |
| logD: | -2.0061 |
| logSw: | -2.2751 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.988 |
| InChI Key: | HZHRPAGNRIOZKF-UHFFFAOYSA-N |