4-[(4-tert-butylphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(4-tert-butylphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
4-[(4-tert-butylphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K074-6535 |
| Compound Name: | 4-[(4-tert-butylphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 350.37 |
| Molecular Formula: | C20 H18 N2 O4 |
| Smiles: | CC(C)(C)c1ccc(\C=C2/C(=O)OC(c3ccc(cc3)[N+]([O-])=O)=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.018 |
| logD: | 5.018 |
| logSw: | -4.7857 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.757 |
| InChI Key: | QYJOAGGTOBLPLT-UHFFFAOYSA-N |