N-(2H-1,3-benzodioxol-5-yl)-1-(3,4-dimethoxybenzene-1-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-1-(3,4-dimethoxybenzene-1-sulfonyl)piperidine-3-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-1-(3,4-dimethoxybenzene-1-sulfonyl)piperidine-3-carboxamide
Compound characteristics
Compound ID: | Y050-1204 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-1-(3,4-dimethoxybenzene-1-sulfonyl)piperidine-3-carboxamide |
Molecular Weight: | 448.49 |
Molecular Formula: | C21 H24 N2 O7 S |
Smiles: | COc1ccc(cc1OC)S(N1CCCC(C1)C(Nc1ccc2c(c1)OCO2)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.102 |
logD: | 2.1012 |
logSw: | -3.0243 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.35 |
InChI Key: | MZDQNNVZMLLMCM-AWEZNQCLSA-N |