N~4~-benzyl-N~1~-[(3,4-dimethoxyphenyl)methyl]-N~1~-(2-methylcyclohexyl)benzene-1,4-disulfonamide
Chemical Structure Depiction of
N~4~-benzyl-N~1~-[(3,4-dimethoxyphenyl)methyl]-N~1~-(2-methylcyclohexyl)benzene-1,4-disulfonamide
N~4~-benzyl-N~1~-[(3,4-dimethoxyphenyl)methyl]-N~1~-(2-methylcyclohexyl)benzene-1,4-disulfonamide
Compound characteristics
| Compound ID: | D207-0113 |
| Compound Name: | N~4~-benzyl-N~1~-[(3,4-dimethoxyphenyl)methyl]-N~1~-(2-methylcyclohexyl)benzene-1,4-disulfonamide |
| Molecular Weight: | 572.74 |
| Molecular Formula: | C29 H36 N2 O6 S2 |
| Smiles: | CC1CCCCC1N(Cc1ccc(c(c1)OC)OC)S(c1ccc(cc1)S(NCc1ccccc1)(=O)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1182 |
| logD: | 5.1179 |
| logSw: | -5.0813 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.11 |
| InChI Key: | BHBTWJAKJNQUBM-UHFFFAOYSA-N |