2-{2-[(3-methylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{2-[(3-methylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(thiophen-2-yl)methyl]acetamide
2-{2-[(3-methylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | K788-8154 |
| Compound Name: | 2-{2-[(3-methylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C23 H20 N2 O3 S |
| Smiles: | Cc1cccc(\C=C2/C(N(CC(NCc3cccs3)=O)c3ccccc3O2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.4473 |
| logD: | 4.4473 |
| logSw: | -4.3958 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.523 |
| InChI Key: | JEPPHYQMUQZRGC-UHFFFAOYSA-N |