2-(5-chlorothiophen-2-yl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(5-chlorothiophen-2-yl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]quinoline-4-carboxamide
2-(5-chlorothiophen-2-yl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C228-0370 |
| Compound Name: | 2-(5-chlorothiophen-2-yl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]quinoline-4-carboxamide |
| Molecular Weight: | 462.01 |
| Molecular Formula: | C26 H24 Cl N3 O S |
| Smiles: | C(CNC(c1cc(c2ccc(s2)[Cl])nc2ccccc12)=O)CN1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 6.1418 |
| logD: | 4.992 |
| logSw: | -6.213 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.215 |
| InChI Key: | WCFCQCFHFYHSEQ-UHFFFAOYSA-N |