4-fluoro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-fluoro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-fluoro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-1108 |
| Compound Name: | 4-fluoro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 554.6 |
| Molecular Formula: | C21 H33 F N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | C1CCN(CC1)CCCN(CCC(N1CCNCC1)=O)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.038 |
| logD: | -0.716 |
| logSw: | -2.3112 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.635 |
| InChI Key: | QCAONUWVTOUNHY-UHFFFAOYSA-N |