5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-chloroanilino)-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-chloroanilino)-1,3-thiazol-4(5H)-one
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-chloroanilino)-1,3-thiazol-4(5H)-one
Compound characteristics
| Compound ID: | 4611-0022 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-(2-chloroanilino)-1,3-thiazol-4(5H)-one |
| Molecular Weight: | 358.8 |
| Molecular Formula: | C17 H11 Cl N2 O3 S |
| Smiles: | C1Oc2ccc(\C=C3/C(N=C(Nc4ccccc4[Cl])S3)=O)cc2O1 |
| Stereo: | ACHIRAL |
| logP: | 3.9611 |
| logD: | 3.9511 |
| logSw: | -4.3966 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.042 |
| InChI Key: | SVZBIZXAGNXFAT-UHFFFAOYSA-N |