4-bromo-N-[3-(2,5-dimethoxyanilino)quinoxalin-2-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-[3-(2,5-dimethoxyanilino)quinoxalin-2-yl]benzene-1-sulfonamide
4-bromo-N-[3-(2,5-dimethoxyanilino)quinoxalin-2-yl]benzene-1-sulfonamide
Compound characteristics
Compound ID: | 5122-2769 |
Compound Name: | 4-bromo-N-[3-(2,5-dimethoxyanilino)quinoxalin-2-yl]benzene-1-sulfonamide |
Molecular Weight: | 515.38 |
Molecular Formula: | C22 H19 Br N4 O4 S |
Smiles: | COc1ccc(c(c1)Nc1c(NS(c2ccc(cc2)[Br])(=O)=O)nc2ccccc2n1)OC |
Stereo: | ACHIRAL |
logP: | 5.4 |
logD: | 4.1463 |
logSw: | -5.5631 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 82.489 |
InChI Key: | PBHBDGBULFUYPA-UHFFFAOYSA-N |