5-nitro-2-(2-{2-[(prop-2-en-1-yl)oxy]phenyl}ethenyl)pyrimidine-4,6-diol
Chemical Structure Depiction of
5-nitro-2-(2-{2-[(prop-2-en-1-yl)oxy]phenyl}ethenyl)pyrimidine-4,6-diol
5-nitro-2-(2-{2-[(prop-2-en-1-yl)oxy]phenyl}ethenyl)pyrimidine-4,6-diol
Compound characteristics
| Compound ID: | 8017-7318 |
| Compound Name: | 5-nitro-2-(2-{2-[(prop-2-en-1-yl)oxy]phenyl}ethenyl)pyrimidine-4,6-diol |
| Molecular Weight: | 315.28 |
| Molecular Formula: | C15 H13 N3 O5 |
| Smiles: | C=CCOc1ccccc1/C=C/c1nc(c(c(n1)O)[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 2.7791 |
| logD: | -1.6177 |
| logSw: | -3.1187 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.733 |
| InChI Key: | BWQSEDWWDUFANW-UHFFFAOYSA-N |