2-(2-methoxy-5-nitrophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2-methoxy-5-nitrophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(2-methoxy-5-nitrophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1387 |
| Compound Name: | 2-(2-methoxy-5-nitrophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 414.37 |
| Molecular Formula: | C20 H18 N2 O8 |
| Smiles: | COc1ccc(cc1C1=NC(=C\c2cc(c(c(c2)OC)OC)OC)\C(=O)O1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7285 |
| logD: | 2.7285 |
| logSw: | -3.4717 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 94.365 |
| InChI Key: | CBFHJOGGUGENAZ-UHFFFAOYSA-N |