N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-methyl-2-phenyl-1H-benzimidazole-5-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-methyl-2-phenyl-1H-benzimidazole-5-sulfonamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-methyl-2-phenyl-1H-benzimidazole-5-sulfonamide
Compound characteristics
Compound ID: | E511-3544 |
Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-methyl-2-phenyl-1H-benzimidazole-5-sulfonamide |
Molecular Weight: | 460.55 |
Molecular Formula: | C25 H24 N4 O3 S |
Smiles: | CN(CC(N1CCc2ccccc2C1)=O)S(c1ccc2c(c1)nc(c1ccccc1)[nH]2)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.9374 |
logD: | 3.9329 |
logSw: | -3.9993 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.877 |
InChI Key: | IQJDTGTWUAMJLW-UHFFFAOYSA-N |