2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(4-methylcyclohexyl)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-methylcyclohexyl)acetamide
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(4-methylcyclohexyl)acetamide
Compound characteristics
| Compound ID: | K788-5915 |
| Compound Name: | 2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(4-methylcyclohexyl)acetamide |
| Molecular Weight: | 499.4 |
| Molecular Formula: | C25 H27 Br N2 O4 |
| Smiles: | CC1CCC(CC1)NC(CN1C(/C(=C/c2ccc(c(c2)[Br])OC)Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3828 |
| logD: | 5.3828 |
| logSw: | -5.3775 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.86 |
| InChI Key: | NJSMRXBPDSIBEA-UHFFFAOYSA-N |