4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | F594-0885 |
Compound Name: | 4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 516.56 |
Molecular Formula: | C22 H34 N4 O3 |
Salt: | CF3COOH |
Smiles: | COc1ccc(cc1)C(N(CCC(N1CCNCC1)=O)CCN1CCCCC1)=O |
Stereo: | ACHIRAL |
logP: | 0.356 |
logD: | -0.4719 |
logSw: | -1.6142 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.014 |
InChI Key: | TXPUIIDSJAISLT-UHFFFAOYSA-N |