2-[(3-chlorophenyl)methylidene]-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
2-[(3-chlorophenyl)methylidene]-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
2-[(3-chlorophenyl)methylidene]-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C310-1659 |
| Compound Name: | 2-[(3-chlorophenyl)methylidene]-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 565.11 |
| Molecular Formula: | C30 H30 Cl F N4 O2 S |
| Smiles: | CN1C(/C(=C/c2cccc(c2)[Cl])Sc2ccc(cc12)C(NCCCN1CCN(CC1)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9751 |
| logD: | 4.4312 |
| logSw: | -5.0482 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.604 |
| InChI Key: | KMDFRJJLAJNWMI-UHFFFAOYSA-N |