2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-methylacetamide
Chemical Structure Depiction of
2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-methylacetamide
2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-methylacetamide
Compound characteristics
Compound ID: | K788-1845 |
Compound Name: | 2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-methylacetamide |
Molecular Weight: | 364.44 |
Molecular Formula: | C22 H24 N2 O3 |
Smiles: | CC(C)(C)c1ccc2c(c1)N(CC(NC)=O)C(/C(=C/c1ccccc1)O2)=O |
Stereo: | ACHIRAL |
logP: | 3.7235 |
logD: | 3.7235 |
logSw: | -4.0466 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.926 |
InChI Key: | NFNFDCXUMCGXRC-UHFFFAOYSA-N |