N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
Chemical Structure Depiction of
N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
Compound characteristics
| Compound ID: | 8013-9001 |
| Compound Name: | N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide |
| Molecular Weight: | 578.64 |
| Molecular Formula: | C29 H30 N4 O7 S |
| Smiles: | CN1C(N(C)c2cc(ccc12)S(Nc1cc(c(cc1Cc1c2cc(c(cc2ccn1)OC)OC)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4478 |
| logD: | 3.3944 |
| logSw: | -3.7762 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.167 |
| InChI Key: | LDLCLQISTOPJFC-UHFFFAOYSA-N |