N,4-diethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N,4-diethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N,4-diethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0431 |
| Compound Name: | N,4-diethyl-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: | CCc1ccc(cc1)S(N(CC)CC(N1CCNCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1086 |
| logD: | 0.5491 |
| logSw: | -2.4506 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.692 |
| InChI Key: | KWURTIPOIBIHFJ-UHFFFAOYSA-N |