5-chloro-2-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-chloro-2-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
5-chloro-2-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-1220 |
| Compound Name: | 5-chloro-2-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]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(CCC(N1CCNCC1)=O)CCN1CCCCC1)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.0576 |
| logD: | 0.2296 |
| logSw: | -2.8961 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.265 |
| InChI Key: | XLCRWLNPEDPJIO-UHFFFAOYSA-N |