2-{2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(4-chlorophenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(4-chlorophenyl)ethyl]acetamide
2-{2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(4-chlorophenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K788-6313 |
| Compound Name: | 2-{2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(4-chlorophenyl)ethyl]acetamide |
| Molecular Weight: | 485.34 |
| Molecular Formula: | C25 H19 Cl2 F N2 O3 |
| Smiles: | C(CNC(CN1C(/C(=C/c2c(cccc2[Cl])F)Oc2ccccc12)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7125 |
| logD: | 4.7125 |
| logSw: | -4.9821 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.346 |
| InChI Key: | MUBQHACUODPJAA-UHFFFAOYSA-N |