2-{(2E)-2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2-methylcyclohexyl)acetamide
Chemical Structure Depiction of
2-{(2E)-2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2-methylcyclohexyl)acetamide
2-{(2E)-2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2-methylcyclohexyl)acetamide
Compound characteristics
| Compound ID: | K788-0554 |
| Compound Name: | 2-{(2E)-2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2-methylcyclohexyl)acetamide |
| Molecular Weight: | 469.38 |
| Molecular Formula: | C24 H25 Br N2 O3 |
| Smiles: | CC1CCCCC1NC(CN1C(/C(=C\c2cccc(c2)[Br])Oc2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3693 |
| logD: | 5.3693 |
| logSw: | -5.3297 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.62 |
| InChI Key: | RKITXPVRRMTCSU-UHFFFAOYSA-N |