2-(5-bromothiophen-2-yl)-N-{2-[butyl(methyl)amino]ethyl}quinoline-4-carboxamide
Chemical Structure Depiction of
2-(5-bromothiophen-2-yl)-N-{2-[butyl(methyl)amino]ethyl}quinoline-4-carboxamide
2-(5-bromothiophen-2-yl)-N-{2-[butyl(methyl)amino]ethyl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C167-0300 |
| Compound Name: | 2-(5-bromothiophen-2-yl)-N-{2-[butyl(methyl)amino]ethyl}quinoline-4-carboxamide |
| Molecular Weight: | 446.41 |
| Molecular Formula: | C21 H24 Br N3 O S |
| Smiles: | CCCCN(C)CCNC(c1cc(c2ccc(s2)[Br])nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5445 |
| logD: | 4.596 |
| logSw: | -5.5314 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.915 |
| InChI Key: | CXGSFPPGEVHLGN-UHFFFAOYSA-N |