2-(2H-1,3-benzodioxol-5-yl)-N-[(thiophen-2-yl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-[(thiophen-2-yl)methyl]quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-[(thiophen-2-yl)methyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | 6048-0480 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-[(thiophen-2-yl)methyl]quinoline-4-carboxamide |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C22 H16 N2 O3 S |
| Smiles: | C(c1cccs1)NC(c1cc(c2ccc3c(c2)OCO3)nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.293 |
| logD: | 5.2921 |
| logSw: | -5.9404 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.845 |
| InChI Key: | NPMAUCPTVZSZQC-UHFFFAOYSA-N |