N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Compound characteristics
| Compound ID: | K788-4936 |
| Compound Name: | N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide |
| Molecular Weight: | 516.64 |
| Molecular Formula: | C29 H29 F N4 O2 S |
| Smiles: | C(CNC(c1ccc(\C=C2/C(Nc3ccccc3S2)=O)cc1)=O)CN1CCN(CC1)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 4.1492 |
| logD: | 3.848 |
| logSw: | -4.1482 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.041 |
| InChI Key: | MDGIGCYXAMFNTI-UHFFFAOYSA-N |