N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~4~-cyclohexyl-N~1~-[(3,4-dimethoxyphenyl)methyl]benzene-1,4-disulfonamide
Chemical Structure Depiction of
N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~4~-cyclohexyl-N~1~-[(3,4-dimethoxyphenyl)methyl]benzene-1,4-disulfonamide
N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~4~-cyclohexyl-N~1~-[(3,4-dimethoxyphenyl)methyl]benzene-1,4-disulfonamide
Compound characteristics
| Compound ID: | D207-0120 |
| Compound Name: | N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~4~-cyclohexyl-N~1~-[(3,4-dimethoxyphenyl)methyl]benzene-1,4-disulfonamide |
| Molecular Weight: | 602.73 |
| Molecular Formula: | C29 H34 N2 O8 S2 |
| Smiles: | COc1ccc(CN(Cc2ccc3c(c2)OCO3)S(c2ccc(cc2)S(NC2CCCCC2)(=O)=O)(=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.1465 |
| logD: | 5.1465 |
| logSw: | -5.0389 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.416 |
| InChI Key: | AOGRQVYFHDCUPZ-UHFFFAOYSA-N |