2-(2-methoxy-3-methylphenyl)-4-[(4-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2-methoxy-3-methylphenyl)-4-[(4-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(2-methoxy-3-methylphenyl)-4-[(4-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0573 |
| Compound Name: | 2-(2-methoxy-3-methylphenyl)-4-[(4-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 338.32 |
| Molecular Formula: | C18 H14 N2 O5 |
| Smiles: | Cc1cccc(C2=NC(=C/c3ccc(cc3)[N+]([O-])=O)\C(=O)O2)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5979 |
| logD: | 3.5979 |
| logSw: | -3.9207 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.474 |
| InChI Key: | YNPYGQVDEXIICA-UHFFFAOYSA-N |