4-[(3,4-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(3,4-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
4-[(3,4-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K074-6552 |
| Compound Name: | 4-[(3,4-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 354.32 |
| Molecular Formula: | C18 H14 N2 O6 |
| Smiles: | COc1ccc(\C=C2/C(=O)OC(c3ccc(cc3)[N+]([O-])=O)=N2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.8221 |
| logD: | 2.8221 |
| logSw: | -3.4796 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.018 |
| InChI Key: | ZRFWFMCSJCCNQW-UHFFFAOYSA-N |