3,4-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3,4-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
3,4-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-1148 |
| Compound Name: | 3,4-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 582.64 |
| Molecular Formula: | C22 H36 N4 O5 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1OC)S(N(CCCN1CCCC1)CCC(N1CCNCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2509 |
| logD: | -1.9352 |
| logSw: | -2.4077 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.261 |
| InChI Key: | GLPJARRESVSYTB-UHFFFAOYSA-N |