2-(3,4-dimethoxyphenyl)-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(3,4-dimethoxyphenyl)-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 1894-8916 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 354.32 |
| Molecular Formula: | C18 H14 N2 O6 |
| Smiles: | COc1ccc(cc1OC)C1=NC(=C/c2cccc(c2)[N+]([O-])=O)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 2.7047 |
| logD: | 2.7047 |
| logSw: | -3.1992 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.018 |
| InChI Key: | MLLFXFYZQBJIGV-UHFFFAOYSA-N |