N-cyclooctyl-2-{2-[(4-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
Chemical Structure Depiction of
N-cyclooctyl-2-{2-[(4-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
N-cyclooctyl-2-{2-[(4-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
Compound characteristics
| Compound ID: | C311-1004 |
| Compound Name: | N-cyclooctyl-2-{2-[(4-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C25 H27 F N2 O3 |
| Smiles: | C1CCCC(CCC1)NC(CN1C(/C(=C\c2ccc(cc2)F)Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2403 |
| logD: | 5.2403 |
| logSw: | -5.2653 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.561 |
| InChI Key: | NZYNFRYINBISCD-UHFFFAOYSA-N |