2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(4-phenylbutan-2-yl)acetamide
Chemical Structure Depiction of
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(4-phenylbutan-2-yl)acetamide
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(4-phenylbutan-2-yl)acetamide
Compound characteristics
| Compound ID: | K788-5924 |
| Compound Name: | 2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(4-phenylbutan-2-yl)acetamide |
| Molecular Weight: | 535.44 |
| Molecular Formula: | C28 H27 Br N2 O4 |
| Smiles: | CC(CCc1ccccc1)NC(CN1C(/C(=C/c2ccc(c(c2)[Br])OC)Oc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3041 |
| logD: | 5.3041 |
| logSw: | -5.3195 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.576 |
| InChI Key: | ZMYFLPYKRWGQEJ-IBGZPJMESA-N |