2-[4-(heptyloxy)phenyl]-4-[(3-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-[4-(heptyloxy)phenyl]-4-[(3-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-[4-(heptyloxy)phenyl]-4-[(3-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 0782-7011 |
| Compound Name: | 2-[4-(heptyloxy)phenyl]-4-[(3-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 489.35 |
| Molecular Formula: | C23 H24 I N O3 |
| Smiles: | CCCCCCCOc1ccc(cc1)C1=NC(=C/c2cccc(c2)I)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 7.1908 |
| logD: | 7.1908 |
| logSw: | -5.7194 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.793 |
| InChI Key: | CHOKFDWTZYTIDD-UHFFFAOYSA-N |