2-(2H-1,3-benzodioxol-5-yl)-4-[(4-chlorophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-4-[(4-chlorophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(2H-1,3-benzodioxol-5-yl)-4-[(4-chlorophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2062-0541 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-4-[(4-chlorophenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 327.72 |
| Molecular Formula: | C17 H10 Cl N O4 |
| Smiles: | C1Oc2ccc(cc2O1)C1=NC(=C/c2ccc(cc2)[Cl])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.7892 |
| logD: | 3.7892 |
| logSw: | -4.7416 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.491 |
| InChI Key: | BWYWNRYEBZGNPH-UHFFFAOYSA-N |