4-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-phenyl-1,2-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-phenyl-1,2-oxazol-5(4H)-one
4-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-phenyl-1,2-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5408-0987 |
| Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-phenyl-1,2-oxazol-5(4H)-one |
| Molecular Weight: | 293.28 |
| Molecular Formula: | C17 H11 N O4 |
| Smiles: | C1Oc2ccc(\C=C3/C(c4ccccc4)=NOC3=O)cc2O1 |
| Stereo: | ACHIRAL |
| logP: | 3.038 |
| logD: | 3.038 |
| logSw: | -3.2738 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.807 |
| InChI Key: | HXPYADVNHOGEER-UHFFFAOYSA-N |