RefChem:539688

2-[2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethenyl]-N,N,1-trimethylquinolin-1-ium-6-amine;methyl sulfate

Also Known As: EINECS 263-201-4|6-2-[2- vinyl]-1-methylquinoliniummethylsulphate|6-(Dimethylamino)-2-(2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl)-1-methylquinolinium methyl sulphate|6-(dimethylamino)-2-[2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl]-1-methylquinolinium methyl sulphate|2-[2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethenyl]-N,N,1-trimethylquinolin-1-ium-6-amine;methyl sulfate|2-[2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethenyl]-N,N,1-trimethylquinolin-1-ium-6-amine,methyl sulfate|2-[2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethenyl]-N,N,1-trimethylquinolin-1-ium-6-amine; methyl sulfate|263-201-4|6-(Dimethylamino)-2-[2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)ethen-1-yl]-1-methylquinolin-1-ium methyl sulfate|6-(DIMETHYLAMINO)-2-[2-(2,5-DIMETHYL-1-PHENYL-1H-PYRROL-3-YL)VINYL]-1-METHYLQUINOLINIUM METHYL SULFATE|Quinolinium, 6-(dimethylamino)-2-[2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)ethenyl]-1-methyl-, methyl sulfate

Molecular Formula	C27H31N3O4S
Molecular Weight	493.20352 g/mol
LogP	4.4
Topological Polar Surface Area	78.48 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	493.20352
Heavy Atoms	35
Complexity	1457.1

Chemical Identifiers

CAS Number	61791-77-3
SMILES	CC1=CC(=C(N1C2=CC=CC=C2)C)C=CC3=[N+](C4=C(C=C3)C=C(C=C4)N(C)C)C.COS(=O)(=O)[O-]