2-[(2-chlorophenyl)methylidene]-N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
2-[(2-chlorophenyl)methylidene]-N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
2-[(2-chlorophenyl)methylidene]-N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | F389-0554 |
| Compound Name: | 2-[(2-chlorophenyl)methylidene]-N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 450.94 |
| Molecular Formula: | C24 H19 Cl N2 O3 S |
| Smiles: | CSc1ccc(CNC(c2ccc3c(c2)NC(/C(=C/c2ccccc2[Cl])O3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2369 |
| logD: | 5.2368 |
| logSw: | -5.7799 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.221 |
| InChI Key: | KGHQJKYOGABFGK-UHFFFAOYSA-N |