2-bromo-6-methoxy-4-{[2-(4-methoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
2-bromo-6-methoxy-4-{[2-(4-methoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
2-bromo-6-methoxy-4-{[2-(4-methoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | K088-0679 |
| Compound Name: | 2-bromo-6-methoxy-4-{[2-(4-methoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 446.25 |
| Molecular Formula: | C20 H16 Br N O6 |
| Smiles: | CC(=O)Oc1c(cc(\C=C2/C(=O)OC(c3ccc(cc3)OC)=N2)cc1[Br])OC |
| Stereo: | ACHIRAL |
| logP: | 3.4265 |
| logD: | 3.4265 |
| logSw: | -3.7107 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.474 |
| InChI Key: | OVOFRKZZCQSPQB-UHFFFAOYSA-N |