N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | G777-0167 |
| Compound Name: | N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 427.54 |
| Molecular Formula: | C23 H26 F N3 O2 S |
| Smiles: | C(CNC(c1cccc2C(CCSc12)=O)=O)CN1CCN(CC1)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.0712 |
| logD: | 2.5273 |
| logSw: | -3.7435 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.905 |
| InChI Key: | KEWSYDNONLVJIG-UHFFFAOYSA-N |