N-[(1-ethylpyrrolidin-2-yl)methyl]-4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(1-ethylpyrrolidin-2-yl)methyl]-4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[(1-ethylpyrrolidin-2-yl)methyl]-4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0504 |
| Compound Name: | N-[(1-ethylpyrrolidin-2-yl)methyl]-4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 526.55 |
| Molecular Formula: | C19 H29 F N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCN1CCCC1CN(CC(N1CCNCC1)=O)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.321 |
| logD: | -0.2385 |
| logSw: | -2.4673 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.602 |
| InChI Key: | NVSIEOJWYUXWCU-QGZVFWFLSA-N |