2-iodo-6-methoxy-4-{[2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
2-iodo-6-methoxy-4-{[2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
2-iodo-6-methoxy-4-{[2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | 2047-9585 |
| Compound Name: | 2-iodo-6-methoxy-4-{[2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 544.3 |
| Molecular Formula: | C23 H17 I N2 O6 |
| Smiles: | CC(=O)Oc1c(cc(/C=C2/C(=O)OC(c3c(c4ccccc4)noc3C)=N2)cc1I)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7983 |
| logD: | 3.7983 |
| logSw: | -4.2669 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.891 |
| InChI Key: | HISHZKPVDJBQNF-UHFFFAOYSA-N |