6-tert-butyl-2-[(4-chlorophenyl)methylidene]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-tert-butyl-2-[(4-chlorophenyl)methylidene]-2H-1,4-benzoxazin-3(4H)-one
6-tert-butyl-2-[(4-chlorophenyl)methylidene]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | K783-5232 |
| Compound Name: | 6-tert-butyl-2-[(4-chlorophenyl)methylidene]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 327.81 |
| Molecular Formula: | C19 H18 Cl N O2 |
| Smiles: | CC(C)(C)c1ccc2c(c1)NC(/C(=C/c1ccc(cc1)[Cl])O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6175 |
| logD: | 5.6175 |
| logSw: | -6.2023 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.808 |
| InChI Key: | GWIKEEPHFKUCHK-UHFFFAOYSA-N |