2-{2-[(3-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[3-(3-methylpiperidin-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-{2-[(3-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[3-(3-methylpiperidin-1-yl)propyl]acetamide
2-{2-[(3-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[3-(3-methylpiperidin-1-yl)propyl]acetamide
Compound characteristics
| Compound ID: | K788-5007 |
| Compound Name: | 2-{2-[(3-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[3-(3-methylpiperidin-1-yl)propyl]acetamide |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C26 H30 F N3 O3 |
| Smiles: | CC1CCCN(CCCNC(CN2C(/C(=C\c3cccc(c3)F)Oc3ccccc23)=O)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4509 |
| logD: | 0.8214 |
| logSw: | -3.8991 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.262 |
| InChI Key: | JYHWUXJCKNJIFU-IBGZPJMESA-N |