N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2,5-dimethoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2,5-dimethoxybenzene-1-sulfonamide
N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2,5-dimethoxybenzene-1-sulfonamide
Compound characteristics
Compound ID: | 8013-9030 |
Compound Name: | N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2,5-dimethoxybenzene-1-sulfonamide |
Molecular Weight: | 554.62 |
Molecular Formula: | C28 H30 N2 O8 S |
Smiles: | COc1ccc(c(c1)S(Nc1cc(c(cc1Cc1c2cc(c(cc2ccn1)OC)OC)OC)OC)(=O)=O)OC |
Stereo: | ACHIRAL |
logP: | 3.7616 |
logD: | 3.692 |
logSw: | -3.9406 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 95.657 |
InChI Key: | VIWXKMRVBPBXCX-UHFFFAOYSA-N |