4-[(6-chloro-4-oxo-4H-1-benzopyran-3-yl)methylidene]-2-phenyl-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(6-chloro-4-oxo-4H-1-benzopyran-3-yl)methylidene]-2-phenyl-1,3-oxazol-5(4H)-one
4-[(6-chloro-4-oxo-4H-1-benzopyran-3-yl)methylidene]-2-phenyl-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-3042 |
| Compound Name: | 4-[(6-chloro-4-oxo-4H-1-benzopyran-3-yl)methylidene]-2-phenyl-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 351.74 |
| Molecular Formula: | C19 H10 Cl N O4 |
| Smiles: | C(\C1=COc2ccc(cc2C1=O)[Cl])=C1/C(=O)OC(c2ccccc2)=N1 |
| Stereo: | ACHIRAL |
| logP: | 3.5421 |
| logD: | 3.5421 |
| logSw: | -4.107 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.269 |
| InChI Key: | VECUWFLTPUNNLN-UHFFFAOYSA-N |