3-{[5-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
3-{[5-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
3-{[5-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | K074-0854 |
| Compound Name: | 3-{[5-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 397.38 |
| Molecular Formula: | C21 H19 N O7 |
| Smiles: | CC(=O)Oc1cccc(/C=C2/C(=O)OC(c3cc(c(c(c3)OC)OC)OC)=N2)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.2978 |
| logD: | 2.2978 |
| logSw: | -2.944 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.105 |
| InChI Key: | CYJKDPKPKXDEEA-UHFFFAOYSA-N |