2,6-diiodo-4-{[2-(3-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
2,6-diiodo-4-{[2-(3-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
2,6-diiodo-4-{[2-(3-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | 8002-5777 |
| Compound Name: | 2,6-diiodo-4-{[2-(3-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 573.12 |
| Molecular Formula: | C19 H13 I2 N O4 |
| Smiles: | CC(=O)Oc1c(cc(/C=C2/C(=O)OC(c3cccc(C)c3)=N2)cc1I)I |
| Stereo: | ACHIRAL |
| logP: | 4.9532 |
| logD: | 4.9532 |
| logSw: | -4.8438 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.3 |
| InChI Key: | AZALDESPFJMULW-UHFFFAOYSA-N |