2-(5-bromothiophen-2-yl)-N-(3,5-dimethoxyphenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
2-(5-bromothiophen-2-yl)-N-(3,5-dimethoxyphenyl)quinoline-4-carboxamide
2-(5-bromothiophen-2-yl)-N-(3,5-dimethoxyphenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C228-0562 |
| Compound Name: | 2-(5-bromothiophen-2-yl)-N-(3,5-dimethoxyphenyl)quinoline-4-carboxamide |
| Molecular Weight: | 469.36 |
| Molecular Formula: | C22 H17 Br N2 O3 S |
| Smiles: | COc1cc(cc(c1)OC)NC(c1cc(c2ccc(s2)[Br])nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2121 |
| logD: | 6.212 |
| logSw: | -5.7696 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.495 |
| InChI Key: | JURKAGRWUBMNBI-UHFFFAOYSA-N |