4-[(2,3-dimethoxyphenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2,3-dimethoxyphenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
4-[(2,3-dimethoxyphenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0989 |
| Compound Name: | 4-[(2,3-dimethoxyphenyl)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 380.36 |
| Molecular Formula: | C20 H16 N2 O6 |
| Smiles: | COc1cccc(\C=C2/C(=O)OC(/C=C\c3cccc(c3)[N+]([O-])=O)=N2)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.7643 |
| logD: | 3.7643 |
| logSw: | -4.1635 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.251 |
| InChI Key: | ZRODHFAECCWNKR-UHFFFAOYSA-N |