2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-cyclohexylacetamide
Chemical Structure Depiction of
2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-cyclohexylacetamide
2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-cyclohexylacetamide
Compound characteristics
| Compound ID: | K788-1851 |
| Compound Name: | 2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-cyclohexylacetamide |
| Molecular Weight: | 432.56 |
| Molecular Formula: | C27 H32 N2 O3 |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(CC(NC1CCCCC1)=O)C(/C(=C/c1ccccc1)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.858 |
| logD: | 5.858 |
| logSw: | -5.462 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.229 |
| InChI Key: | KRCNTJFFYUSIHE-UHFFFAOYSA-N |