2-(5-chloro-2-methoxyphenyl)-4-[(3-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(5-chloro-2-methoxyphenyl)-4-[(3-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
2-(5-chloro-2-methoxyphenyl)-4-[(3-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2047-9634 |
| Compound Name: | 2-(5-chloro-2-methoxyphenyl)-4-[(3-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 373.75 |
| Molecular Formula: | C17 H12 Cl N3 O5 |
| Smiles: | COc1ccc(cc1C1=NC(=C/Nc2cccc(c2)[N+]([O-])=O)\C(=O)O1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4319 |
| logD: | 3.4234 |
| logSw: | -4.0035 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.989 |
| InChI Key: | SJSCFIWRYILKLH-UHFFFAOYSA-N |