3-{[2-(3,4-dimethoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
3-{[2-(3,4-dimethoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
3-{[2-(3,4-dimethoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | K088-1791 |
| Compound Name: | 3-{[2-(3,4-dimethoxyphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 367.36 |
| Molecular Formula: | C20 H17 N O6 |
| Smiles: | CC(=O)Oc1cccc(\C=C2/C(=O)OC(c3ccc(c(c3)OC)OC)=N2)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.2643 |
| logD: | 2.2643 |
| logSw: | -2.7561 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.387 |
| InChI Key: | JVFVHHHNWWSIBH-UHFFFAOYSA-N |