2-[2-(4-chlorophenyl)ethenyl]-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-[2-(4-chlorophenyl)ethenyl]-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-[2-(4-chlorophenyl)ethenyl]-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1597 |
| Compound Name: | 2-[2-(4-chlorophenyl)ethenyl]-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 399.83 |
| Molecular Formula: | C21 H18 Cl N O5 |
| Smiles: | COc1cc(\C=C2/C(=O)OC(/C=C/c3ccc(cc3)[Cl])=N2)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.3172 |
| logD: | 4.3172 |
| logSw: | -4.9674 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.5 |
| InChI Key: | AJMCQIHIXXTRFP-UHFFFAOYSA-N |