1-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}-N~3~,N~4~-dimethyl-1H-pyrrole-3,4-disulfonamide
Chemical Structure Depiction of
1-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}-N~3~,N~4~-dimethyl-1H-pyrrole-3,4-disulfonamide
1-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}-N~3~,N~4~-dimethyl-1H-pyrrole-3,4-disulfonamide
Compound characteristics
| Compound ID: | E882-1346 |
| Compound Name: | 1-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}-N~3~,N~4~-dimethyl-1H-pyrrole-3,4-disulfonamide |
| Molecular Weight: | 497.59 |
| Molecular Formula: | C20 H27 N5 O6 S2 |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(Cn1cc(c(c1)S(NC)(=O)=O)S(NC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.5491 |
| logD: | -0.5492 |
| logSw: | -2.0587 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 119.615 |
| InChI Key: | WBDHMWCPURBYHX-UHFFFAOYSA-N |