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 |