2-(2-methoxy-5-nitrophenyl)-4-[(3-methoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2-methoxy-5-nitrophenyl)-4-[(3-methoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(2-methoxy-5-nitrophenyl)-4-[(3-methoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1411 |
| Compound Name: | 2-(2-methoxy-5-nitrophenyl)-4-[(3-methoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 354.32 |
| Molecular Formula: | C18 H14 N2 O6 |
| Smiles: | COc1cccc(\C=C2/C(=O)OC(c3cc(ccc3OC)[N+]([O-])=O)=N2)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9357 |
| logD: | 2.9357 |
| logSw: | -3.5654 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.931 |
| InChI Key: | JXHBVUFPEIBMIA-UHFFFAOYSA-N |