N-ethyl-2,5-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-ethyl-2,5-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-ethyl-2,5-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | F916-0421 |
Compound Name: | N-ethyl-2,5-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 453.48 |
Molecular Formula: | C16 H25 N3 O3 S |
Salt: | CF3COOH |
Smiles: | CCN(CC(N1CCNCC1)=O)S(c1cc(C)ccc1C)(=O)=O |
Stereo: | ACHIRAL |
logP: | 0.938 |
logD: | 0.3785 |
logSw: | -2.4149 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.692 |
InChI Key: | KIAANLTUWODZCX-UHFFFAOYSA-N |