N-(3-methoxypropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzenesulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(3-methoxypropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzenesulfonamide--trifluoroacetic acid (1/1)
N-(3-methoxypropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzenesulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0905 |
| Compound Name: | N-(3-methoxypropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzenesulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 483.51 |
| Molecular Formula: | C17 H27 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | COCCCN(CCC(N1CCNCC1)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.132 |
| logD: | -0.696 |
| logSw: | -2.206 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.266 |
| InChI Key: | FSKSPMRATOKUOK-UHFFFAOYSA-N |