5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-phenyl-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-phenyl-1,3-thiazol-4(5H)-one
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-phenyl-1,3-thiazol-4(5H)-one
Compound characteristics
| Compound ID: | 4896-1039 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-phenyl-1,3-thiazol-4(5H)-one |
| Molecular Weight: | 309.34 |
| Molecular Formula: | C17 H11 N O3 S |
| Smiles: | C1Oc2ccc(/C=C3/C(N=C(c4ccccc4)S3)=O)cc2O1 |
| Stereo: | ACHIRAL |
| logP: | 3.3664 |
| logD: | 3.3664 |
| logSw: | -3.583 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.403 |
| InChI Key: | TYQVKYWUAIBXOD-UHFFFAOYSA-N |