4-[(4-ethoxyphenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(4-ethoxyphenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-1,3-oxazol-5(4H)-one
4-[(4-ethoxyphenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1566 |
| Compound Name: | 4-[(4-ethoxyphenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 352.34 |
| Molecular Formula: | C19 H16 N2 O5 |
| Smiles: | CCOc1ccc(\C=C2/C(=O)OC(c3cccc(c3C)[N+]([O-])=O)=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8492 |
| logD: | 3.8492 |
| logSw: | -4.1021 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.58 |
| InChI Key: | BTJMNCJVYZPLJG-UHFFFAOYSA-N |