1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-N~3~,N~4~-dimethyl-1H-pyrrole-3,4-disulfonamide
Chemical Structure Depiction of
1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-N~3~,N~4~-dimethyl-1H-pyrrole-3,4-disulfonamide
1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-N~3~,N~4~-dimethyl-1H-pyrrole-3,4-disulfonamide
Compound characteristics
Compound ID: | E882-1385 |
Compound Name: | 1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-N~3~,N~4~-dimethyl-1H-pyrrole-3,4-disulfonamide |
Molecular Weight: | 485.58 |
Molecular Formula: | C19 H27 N5 O6 S2 |
Smiles: | CNS(c1cn(CC(N2CCN(CC2)c2ccc(cc2)OC)=O)cc1S(NC)(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | -0.1088 |
logD: | -0.1094 |
logSw: | -2.2364 |
Hydrogen bond acceptors count: | 13 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 113.332 |
InChI Key: | XPIPUXHJNUDBOH-UHFFFAOYSA-N |