N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]-4-(3-methylpiperidine-1-sulfonyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]-4-(3-methylpiperidine-1-sulfonyl)benzene-1-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]-4-(3-methylpiperidine-1-sulfonyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | D207-0152 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]-4-(3-methylpiperidine-1-sulfonyl)benzene-1-sulfonamide |
| Molecular Weight: | 602.73 |
| Molecular Formula: | C29 H34 N2 O8 S2 |
| Smiles: | CC1CCCN(C1)S(c1ccc(cc1)S(N(Cc1ccc(c(c1)OC)OC)Cc1ccc2c(c1)OCO2)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4541 |
| logD: | 4.4541 |
| logSw: | -4.3199 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 95.363 |
| InChI Key: | DXMJHMCYPUTJKN-NRFANRHFSA-N |