4-{[2-(4-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
4-{[2-(4-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
4-{[2-(4-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | 2062-0790 |
| Compound Name: | 4-{[2-(4-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 433.2 |
| Molecular Formula: | C18 H12 I N O4 |
| Smiles: | CC(=O)Oc1ccc(/C=C2/C(=O)OC(c3ccc(cc3)I)=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9878 |
| logD: | 3.9878 |
| logSw: | -4.1791 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.127 |
| InChI Key: | HPYYJNHEJFJYGW-UHFFFAOYSA-N |