N-(1-benzylpiperidin-4-yl)-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-(1-benzylpiperidin-4-yl)-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0792 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 598.68 |
| Molecular Formula: | C26 H36 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cccc(c1)S(N(CCC(N1CCNCC1)=O)C1CCN(CC1)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4725 |
| logD: | 1.6445 |
| logSw: | -2.8584 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.497 |
| InChI Key: | YIXQDYLBNNOTTO-UHFFFAOYSA-N |