2-(4'-octyl[1,1'-biphenyl]-4-yl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4'-octyl[1,1'-biphenyl]-4-yl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(4'-octyl[1,1'-biphenyl]-4-yl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K074-5830 |
| Compound Name: | 2-(4'-octyl[1,1'-biphenyl]-4-yl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 527.66 |
| Molecular Formula: | C33 H37 N O5 |
| Smiles: | CCCCCCCCc1ccc(cc1)c1ccc(cc1)C1=NC(=C\c2cc(c(c(c2)OC)OC)OC)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 8.8821 |
| logD: | 8.8821 |
| logSw: | -5.7471 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.082 |
| InChI Key: | VXGCDIPMFCMYJN-UHFFFAOYSA-N |