8-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}quinoline
Chemical Structure Depiction of
8-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}quinoline
8-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}quinoline
Compound characteristics
Compound ID: | C224-1220 |
Compound Name: | 8-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}quinoline |
Molecular Weight: | 411.48 |
Molecular Formula: | C21 H21 N3 O4 S |
Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)S(c1cccc2cccnc12)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.2854 |
logD: | 2.1903 |
logSw: | -2.8373 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 62.139 |
InChI Key: | DDKTYVHXEFXZGT-UHFFFAOYSA-N |