4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[2-(2,3-dichlorophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[2-(2,3-dichlorophenyl)ethenyl]-1,3-oxazol-5(4H)-one
4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[2-(2,3-dichlorophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
Compound ID: | K088-1690 |
Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[2-(2,3-dichlorophenyl)ethenyl]-1,3-oxazol-5(4H)-one |
Molecular Weight: | 388.2 |
Molecular Formula: | C19 H11 Cl2 N O4 |
Smiles: | C1Oc2ccc(\C=C3/C(=O)OC(/C=C/c4cccc(c4[Cl])[Cl])=N3)cc2O1 |
Stereo: | ACHIRAL |
logP: | 5.019 |
logD: | 5.019 |
logSw: | -5.4477 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 47.637 |
InChI Key: | CNANRBWZEOZZNR-UHFFFAOYSA-N |