2-bromo-6-methoxy-4-{[5-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
2-bromo-6-methoxy-4-{[5-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
2-bromo-6-methoxy-4-{[5-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | K074-0970 |
| Compound Name: | 2-bromo-6-methoxy-4-{[5-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 506.31 |
| Molecular Formula: | C22 H20 Br N O8 |
| Smiles: | CC(=O)Oc1c(cc(/C=C2/C(=O)OC(c3cc(c(c(c3)OC)OC)OC)=N2)cc1[Br])OC |
| Stereo: | ACHIRAL |
| logP: | 3.0761 |
| logD: | 3.0761 |
| logSw: | -3.3022 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.908 |
| InChI Key: | RPSMLSJERSFRKN-UHFFFAOYSA-N |