4-[(2-nitrophenyl)methylidene]-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2-nitrophenyl)methylidene]-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1,3-oxazol-5(4H)-one
4-[(2-nitrophenyl)methylidene]-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K074-5771 |
| Compound Name: | 4-[(2-nitrophenyl)methylidene]-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 482.58 |
| Molecular Formula: | C30 H30 N2 O4 |
| Smiles: | CCCCCCCCc1ccc(cc1)c1ccc(cc1)C1=NC(=C\c2ccccc2[N+]([O-])=O)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 8.934 |
| logD: | 8.934 |
| logSw: | -5.789 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.185 |
| InChI Key: | XRPPMBJJMSSSQC-UHFFFAOYSA-N |