N-[2-(dimethylamino)ethyl]-2-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-2-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[2-(dimethylamino)ethyl]-2-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0235 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-2-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 496.55 |
| Molecular Formula: | C18 H30 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccccc1S(N(CCC(N1CCNCC1)=O)CCN(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1342 |
| logD: | -0.6937 |
| logSw: | -2.1369 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.789 |
| InChI Key: | WAZWCBHGJNJUAC-UHFFFAOYSA-N |