2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K788-1844 |
| Compound Name: | 2-(2-benzylidene-6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 514.62 |
| Molecular Formula: | C31 H34 N2 O5 |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(CC(NCCc1ccc(c(c1)OC)OC)=O)C(/C(=C/c1ccccc1)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9285 |
| logD: | 4.9285 |
| logSw: | -4.5836 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.607 |
| InChI Key: | PWKFSYJADIPTPG-UHFFFAOYSA-N |