2-{(2Z)-2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2,3-dimethylcyclohexyl)acetamide
Chemical Structure Depiction of
2-{(2Z)-2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2,3-dimethylcyclohexyl)acetamide
2-{(2Z)-2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2,3-dimethylcyclohexyl)acetamide
Compound characteristics
| Compound ID: | K788-5911 |
| Compound Name: | 2-{(2Z)-2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2,3-dimethylcyclohexyl)acetamide |
| Molecular Weight: | 513.43 |
| Molecular Formula: | C26 H29 Br N2 O4 |
| Smiles: | CC1CCCC(C1C)NC(CN1C(/C(=C/c2ccc(c(c2)[Br])OC)Oc2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7162 |
| logD: | 4.7162 |
| logSw: | -4.4848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.25 |
| InChI Key: | UIPIQMKLLBCXOS-UHFFFAOYSA-N |