4-[(2-chloroanilino)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2-chloroanilino)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
4-[(2-chloroanilino)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2124-0325 |
| Compound Name: | 4-[(2-chloroanilino)methylidene]-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 369.76 |
| Molecular Formula: | C18 H12 Cl N3 O4 |
| Smiles: | C(=C/c1cccc(c1)[N+]([O-])=O)\C1=NC(=C\Nc2ccccc2[Cl])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.9697 |
| logD: | 3.9511 |
| logSw: | -4.4358 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.806 |
| InChI Key: | JOJDHOACJBAZJT-UHFFFAOYSA-N |