2-{2-[(2-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{2-[(2-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(oxolan-2-yl)methyl]acetamide
2-{2-[(2-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | K788-6267 |
| Compound Name: | 2-{2-[(2-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 457.32 |
| Molecular Formula: | C22 H21 Br N2 O4 |
| Smiles: | C1CC(CNC(CN2C(/C(=C\c3ccccc3[Br])Oc3ccccc23)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0152 |
| logD: | 3.0152 |
| logSw: | -3.4913 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.159 |
| InChI Key: | CGFVIUFDMKJQOD-MRXNPFEDSA-N |