4-[(2-methyl-5-nitroanilino)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2-methyl-5-nitroanilino)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
4-[(2-methyl-5-nitroanilino)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2124-0331 |
| Compound Name: | 4-[(2-methyl-5-nitroanilino)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 394.34 |
| Molecular Formula: | C19 H14 N4 O6 |
| Smiles: | Cc1ccc(cc1N\C=C1/C(=O)OC(/C=C/c2cccc(c2)[N+]([O-])=O)=N1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7999 |
| logD: | 3.6495 |
| logSw: | -4.0181 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 108.188 |
| InChI Key: | YSSWHARIICHKMO-UHFFFAOYSA-N |