2-(2H-1,3-benzodioxol-5-yl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y200-2324 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide |
| Molecular Weight: | 445.5 |
| Molecular Formula: | C24 H19 N3 O4 S |
| Smiles: | Cc1c(C(N)=O)c(NC(c2cc(c3ccc4c(c3)OCO4)nc3ccccc23)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 3.8701 |
| logD: | 3.6141 |
| logSw: | -4.3077 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.357 |
| InChI Key: | JPSQXBBUJWCXRV-UHFFFAOYSA-N |