4-[(2-chloro-6-fluorophenyl)methylidene]-2-(4-methoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2-chloro-6-fluorophenyl)methylidene]-2-(4-methoxyphenyl)-1,3-oxazol-5(4H)-one
4-[(2-chloro-6-fluorophenyl)methylidene]-2-(4-methoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0678 |
| Compound Name: | 4-[(2-chloro-6-fluorophenyl)methylidene]-2-(4-methoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 331.73 |
| Molecular Formula: | C17 H11 Cl F N O3 |
| Smiles: | COc1ccc(cc1)C1=NC(=C/c2c(cccc2[Cl])F)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.6615 |
| logD: | 3.6615 |
| logSw: | -4.2626 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.919 |
| InChI Key: | KHCHPUSAIPVROG-UHFFFAOYSA-N |