2-(3-methoxyphenyl)-4-[(2-methyl-5-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-4-[(2-methyl-5-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
2-(3-methoxyphenyl)-4-[(2-methyl-5-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0473 |
| Compound Name: | 2-(3-methoxyphenyl)-4-[(2-methyl-5-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 353.33 |
| Molecular Formula: | C18 H15 N3 O5 |
| Smiles: | Cc1ccc(cc1N\C=C1/C(=O)OC(c2cccc(c2)OC)=N1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.245 |
| logD: | 3.2303 |
| logSw: | -3.674 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.204 |
| InChI Key: | OIGFCCSZGSLUFE-UHFFFAOYSA-N |