2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-cyclooctylacetamide
Chemical Structure Depiction of
2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-cyclooctylacetamide
2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-cyclooctylacetamide
Compound characteristics
| Compound ID: | C311-0194 |
| Compound Name: | 2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-cyclooctylacetamide |
| Molecular Weight: | 438.95 |
| Molecular Formula: | C25 H27 Cl N2 O3 |
| Smiles: | C1CCCC(CCC1)NC(CN1C(/C(=C\c2cccc(c2)[Cl])Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7502 |
| logD: | 5.7502 |
| logSw: | -5.9579 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.561 |
| InChI Key: | NTBNVHYSHGPQQN-UHFFFAOYSA-N |