2-(4-tert-butylphenyl)-4-[(3-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-4-[(3-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(4-tert-butylphenyl)-4-[(3-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8005-7126 |
| Compound Name: | 2-(4-tert-butylphenyl)-4-[(3-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 431.27 |
| Molecular Formula: | C20 H18 I N O2 |
| Smiles: | CC(C)(C)c1ccc(cc1)C1=NC(=C/c2cccc(c2)I)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 6.0109 |
| logD: | 6.0109 |
| logSw: | -5.5758 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.3756 |
| InChI Key: | XKLRBJHADMKWDH-UHFFFAOYSA-N |