2-[2-(3-nitrophenyl)ethenyl]-4-[(2,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-[2-(3-nitrophenyl)ethenyl]-4-[(2,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-[2-(3-nitrophenyl)ethenyl]-4-[(2,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1005 |
| Compound Name: | 2-[2-(3-nitrophenyl)ethenyl]-4-[(2,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 410.38 |
| Molecular Formula: | C21 H18 N2 O7 |
| Smiles: | COc1cc(c(cc1/C=C1/C(=O)OC(/C=C/c2cccc(c2)[N+]([O-])=O)=N1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.3445 |
| logD: | 3.3445 |
| logSw: | -3.7606 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.794 |
| InChI Key: | PJTGSYQFJJFVCT-UHFFFAOYSA-N |