4-{[2-(3-bromo-4-methoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
4-{[2-(3-bromo-4-methoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
4-{[2-(3-bromo-4-methoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | K088-3102 |
| Compound Name: | 4-{[2-(3-bromo-4-methoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 416.23 |
| Molecular Formula: | C19 H14 Br N O5 |
| Smiles: | CC(=O)Oc1ccc(\C=C2/C(=O)OC(c3ccc(c(c3)[Br])OC)=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3894 |
| logD: | 3.3894 |
| logSw: | -3.7091 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.757 |
| InChI Key: | WKOJSVFHGCKDPD-UHFFFAOYSA-N |