4-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0508 |
| Compound Name: | 4-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 587.45 |
| Molecular Formula: | C19 H29 Br N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCN1CCCC1CN(CC(N1CCNCC1)=O)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1258 |
| logD: | 0.5663 |
| logSw: | -2.3976 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.602 |
| InChI Key: | QSWCFYSKWQQETA-QGZVFWFLSA-N |