2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(2-chlorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(2-chlorophenyl)methyl]acetamide
2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(2-chlorophenyl)methyl]acetamide
Compound characteristics
Compound ID: | K788-2010 |
Compound Name: | 2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(2-chlorophenyl)methyl]acetamide |
Molecular Weight: | 509.43 |
Molecular Formula: | C28 H26 Cl2 N2 O3 |
Smiles: | CC(C)(C)c1ccc2c(c1)N(CC(NCc1ccccc1[Cl])=O)C(/C(=C\c1ccc(cc1)[Cl])O2)=O |
Stereo: | ACHIRAL |
logP: | 7.0092 |
logD: | 7.0092 |
logSw: | -6.2637 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.504 |
InChI Key: | OPRJESBWFARTQM-UHFFFAOYSA-N |