2-(3-iodophenyl)-4-[(4-methoxy-3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3-iodophenyl)-4-[(4-methoxy-3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(3-iodophenyl)-4-[(4-methoxy-3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8001-5422 |
| Compound Name: | 2-(3-iodophenyl)-4-[(4-methoxy-3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 450.19 |
| Molecular Formula: | C17 H11 I N2 O5 |
| Smiles: | COc1ccc(/C=C2/C(=O)OC(c3cccc(c3)I)=N2)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8712 |
| logD: | 3.8712 |
| logSw: | -4.1828 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.087 |
| InChI Key: | ZHKBPQPVUOSKOV-UHFFFAOYSA-N |