N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-1289 |
| Compound Name: | N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 594.69 |
| Molecular Formula: | C24 H40 N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCOc1ccc(cc1)S(N(CCC(N1CCNCC1)=O)CCN1CC(C)CC(C)C1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9864 |
| logD: | 1.1585 |
| logSw: | -2.6218 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.625 |
| InChI Key: | KEDNKVVGKOLJDL-UHFFFAOYSA-N |