4-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-chloro-5-iodophenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-chloro-5-iodophenyl)-1,3-oxazol-5(4H)-one
4-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-chloro-5-iodophenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8007-0770 |
| Compound Name: | 4-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-chloro-5-iodophenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 532.51 |
| Molecular Formula: | C17 H8 Br Cl I N O4 |
| Smiles: | C1Oc2cc(\C=C3/C(=O)OC(c4cc(ccc4[Cl])I)=N3)c(cc2O1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.7275 |
| logD: | 5.7275 |
| logSw: | -6.0939 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.491 |
| InChI Key: | ULJDKTWFWJNPPU-UHFFFAOYSA-N |