{2-[2-(4-hydroxy-5-nitro-6-oxo-1,6-dihydropyrimidin-2-yl)ethenyl]-6-methoxyphenoxy}acetic acid
Chemical Structure Depiction of
{2-[2-(4-hydroxy-5-nitro-6-oxo-1,6-dihydropyrimidin-2-yl)ethenyl]-6-methoxyphenoxy}acetic acid
{2-[2-(4-hydroxy-5-nitro-6-oxo-1,6-dihydropyrimidin-2-yl)ethenyl]-6-methoxyphenoxy}acetic acid
Compound characteristics
| Compound ID: | 8017-4600 |
| Compound Name: | {2-[2-(4-hydroxy-5-nitro-6-oxo-1,6-dihydropyrimidin-2-yl)ethenyl]-6-methoxyphenoxy}acetic acid |
| Molecular Weight: | 363.28 |
| Molecular Formula: | C15 H13 N3 O8 |
| Smiles: | COc1cccc(/C=C/C2NC(C(=C(N=2)O)[N+]([O-])=O)=O)c1OCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7759 |
| logD: | -7.7322 |
| logSw: | -1.9789 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 128.057 |
| InChI Key: | YFOGEHLJFQNLRN-UHFFFAOYSA-N |