4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0022 |
| Compound Name: | 4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 580.62 |
| Molecular Formula: | C22 H34 N4 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCOc1ccc(cc1)S(N(CCCN1CCCC1=O)CCC(N1CCNCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1008 |
| logD: | -0.9287 |
| logSw: | -2.3058 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.288 |
| InChI Key: | VCXURFPFZXTEHX-UHFFFAOYSA-N |