4-ethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-ethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-ethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0727 |
| Compound Name: | 4-ethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 552.61 |
| Molecular Formula: | C21 H34 N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCOc1ccc(cc1)S(N(CCCN1CCCC1)CC(N1CCNCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8101 |
| logD: | -1.3132 |
| logSw: | -2.4713 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.146 |
| InChI Key: | PIMSWEFEEUPJLC-UHFFFAOYSA-N |