5-chloro-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-chloro-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
5-chloro-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0701 |
| Compound Name: | 5-chloro-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 587.06 |
| Molecular Formula: | C21 H33 Cl N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1S(N(CCCN1CCCCC1)CC(N1CCNCC1)=O)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.0851 |
| logD: | -0.6069 |
| logSw: | -2.8658 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.287 |
| InChI Key: | XWCZYPHOYZYHEQ-UHFFFAOYSA-N |