2-[2-(2,3-dichlorophenyl)ethenyl]-4-[(4-oxo-4H-1-benzopyran-3-yl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-[2-(2,3-dichlorophenyl)ethenyl]-4-[(4-oxo-4H-1-benzopyran-3-yl)methylidene]-1,3-oxazol-5(4H)-one
2-[2-(2,3-dichlorophenyl)ethenyl]-4-[(4-oxo-4H-1-benzopyran-3-yl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1714 |
| Compound Name: | 2-[2-(2,3-dichlorophenyl)ethenyl]-4-[(4-oxo-4H-1-benzopyran-3-yl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 412.23 |
| Molecular Formula: | C21 H11 Cl2 N O4 |
| Smiles: | C(=C/c1cccc(c1[Cl])[Cl])\C1=NC(=C/C2=COc3ccccc3C2=O)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.789 |
| logD: | 4.789 |
| logSw: | -5.0249 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.415 |
| InChI Key: | NEMCTZDNTBZRFH-UHFFFAOYSA-N |