4-[(3,4-dimethoxyphenyl)methylidene]-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(3,4-dimethoxyphenyl)methylidene]-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1,3-oxazol-5(4H)-one
4-[(3,4-dimethoxyphenyl)methylidene]-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K074-5760 |
| Compound Name: | 4-[(3,4-dimethoxyphenyl)methylidene]-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 497.64 |
| Molecular Formula: | C32 H35 N O4 |
| Smiles: | CCCCCCCCc1ccc(cc1)c1ccc(cc1)C1=NC(=C/c2ccc(c(c2)OC)OC)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 8.7317 |
| logD: | 8.7317 |
| logSw: | -5.757 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.365 |
| InChI Key: | QVAWMUVQNRSRRL-UHFFFAOYSA-N |