2-{2-[(4-ethylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}acetamide
Chemical Structure Depiction of
2-{2-[(4-ethylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}acetamide
2-{2-[(4-ethylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}acetamide
Compound characteristics
| Compound ID: | K788-2475 |
| Compound Name: | 2-{2-[(4-ethylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}acetamide |
| Molecular Weight: | 558.72 |
| Molecular Formula: | C32 H35 F N4 O2 S |
| Smiles: | CCc1ccc(/C=C2/C(N(CC(NCCCN3CCN(CC3)c3ccc(cc3)F)=O)c3ccccc3S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4769 |
| logD: | 4.8908 |
| logSw: | -5.2701 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.625 |
| InChI Key: | QBJWSKZFWJSMCU-UHFFFAOYSA-N |