4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(3,4-dimethylphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(3,4-dimethylphenyl)-1,3-oxazol-5(4H)-one
4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(3,4-dimethylphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2165-0844 |
| Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(3,4-dimethylphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 321.33 |
| Molecular Formula: | C19 H15 N O4 |
| Smiles: | Cc1ccc(cc1C)C1=NC(=C/c2ccc3c(c2)OCO3)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.1548 |
| logD: | 4.1548 |
| logSw: | -4.3122 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.491 |
| InChI Key: | XUMUGDKGDFTIJM-UHFFFAOYSA-N |