2-(4-chloro-3-nitrophenyl)-4-[(3,5-diiodo-2-methoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-chloro-3-nitrophenyl)-4-[(3,5-diiodo-2-methoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(4-chloro-3-nitrophenyl)-4-[(3,5-diiodo-2-methoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8004-0749 |
| Compound Name: | 2-(4-chloro-3-nitrophenyl)-4-[(3,5-diiodo-2-methoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 610.53 |
| Molecular Formula: | C17 H9 Cl I2 N2 O5 |
| Smiles: | COc1c(/C=C2/C(=O)OC(c3ccc(c(c3)[N+]([O-])=O)[Cl])=N2)cc(cc1I)I |
| Stereo: | ACHIRAL |
| logP: | 5.4737 |
| logD: | 5.4737 |
| logSw: | -6.1224 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.173 |
| InChI Key: | UEFYWFOFUZWUMI-UHFFFAOYSA-N |