N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | F916-0515 |
Compound Name: | N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 550.64 |
Molecular Formula: | C22 H36 N4 O3 S |
Salt: | CF3COOH |
Smiles: | CCN1CCCC1CN(CC(N1CCNCC1)=O)S(c1ccc(cc1)C(C)C)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.6301 |
logD: | 1.0706 |
logSw: | -2.5494 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.602 |
InChI Key: | TZGXHFOYZOAPMS-HXUWFJFHSA-N |