4-[(2-chloro-5-nitroanilino)methylidene]-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2-chloro-5-nitroanilino)methylidene]-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
4-[(2-chloro-5-nitroanilino)methylidene]-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0583 |
| Compound Name: | 4-[(2-chloro-5-nitroanilino)methylidene]-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 393.78 |
| Molecular Formula: | C20 H12 Cl N3 O4 |
| Smiles: | C(=C1/C(=O)OC(c2cccc3ccccc23)=N1)/Nc1cc(ccc1[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2717 |
| logD: | 3.869 |
| logSw: | -4.6222 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.389 |
| InChI Key: | SGQAUQFYURHHOW-UHFFFAOYSA-N |