AC1MI2WB

2-[(3R,4S)-3-ethenylpiperidin-4-yl]-1-(2-phenylquinolin-4-yl)ethanone;dihydrochloride

Also Known As: Ethanone, 2-(3-ethenyl-4-piperidinyl)-1-(2-phenyl-4-quinolinyl)-, dihydrochloride, (3R-cis)-|2-(3(R)-Ethenyl-4(S)-piperidyl)-1-(2-phenyl-4-quinolyl)ethanone dihydrochloride|(3R-cis)-2-(3-Ethenyl-4-piperidinyl)-1-(2-phenyl-4-quinolinyl)ethanone dihydrochloride|2-[(3R,4S)-3-ethenylpiperidin-4-yl]-1-(2-phenylquinolin-4-yl)ethanone dihydrochloride|2-[(3R,4S)-3-Ethenylpiperidin-4-yl]-1-(2-phenylquinolin-4-yl)ethan-1-one--hydrogen chloride (1/2)

Molecular Formula	C24H26Cl2N2O
Molecular Weight	428.1422 g/mol
LogP	5.7299
Topological Polar Surface Area	41.99 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	428.1422
Monoisotopic Mass	428.1422
Heavy Atoms	29
Complexity	975.03644

Chemical Identifiers

CAS Number	80221-49-4
SMILES	C=C[C@H]1CNCC[C@H]1CC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4.Cl.Cl