N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(thiophen-2-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(thiophen-2-yl)quinoline-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(thiophen-2-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C167-0130 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(thiophen-2-yl)quinoline-4-carboxamide |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C22 H16 N2 O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1cc(c2cccs2)nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0764 |
| logD: | 5.0764 |
| logSw: | -5.2108 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.845 |
| InChI Key: | DSAJGLYFKLPVRE-UHFFFAOYSA-N |