N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-N',N'-dimethyl-N-(4-methylphenyl)sulfuric diamide
Chemical Structure Depiction of
N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-N',N'-dimethyl-N-(4-methylphenyl)sulfuric diamide
N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-N',N'-dimethyl-N-(4-methylphenyl)sulfuric diamide
Compound characteristics
| Compound ID: | G906-0466 |
| Compound Name: | N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-N',N'-dimethyl-N-(4-methylphenyl)sulfuric diamide |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C23 H30 N4 O5 S |
| Smiles: | Cc1ccc(cc1)N(CC(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)S(N(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9218 |
| logD: | 1.7302 |
| logSw: | -2.8037 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.199 |
| InChI Key: | MSBFVNGRJPUYLS-UHFFFAOYSA-N |