4-ethoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-ethoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-ethoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-1262 |
| Compound Name: | 4-ethoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 581.65 |
| Molecular Formula: | C22 H37 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCOc1ccc(cc1)S(N(CCC(N1CCNCC1)=O)CCN1CCN(C)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0468 |
| logD: | -0.8747 |
| logSw: | -2.352 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.235 |
| InChI Key: | KQRPGXONBPUAOA-UHFFFAOYSA-N |