RefChem:178315

3-[2-[(1-benzyl-6-methoxyquinolin-1-ium-2-yl)methylidene]benzo[d][1,3]selenazol-1-yl]propane-1-sulfonate

Also Known As: EINECS 264-488-9|6-Methoxy-1-(phenylmethyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)quinolinium hydroxide, inner salt|Quinolinium, 6-methoxy-1-(phenylmethyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)-, hydroxide, inner salt|Quinolinium, 6-methoxy-1-(phenylmethyl)-2-((3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)-, inner salt|1-Benzyl-6-methoxy-2-((3-(3-sulphonatopropyl)-3H-benzoselenazol-2-ylidene)methyl)quinolinium|1-Benzyl-6-methoxy-2-[[3-(3-sulfonatopropyl)-3H-benzoselenazol-2-ylidene]methyl]quinolinium|1-benzyl-6-methoxy-2-[[3-(3-sulphonatopropyl)-3h-benzoselenazol-2-ylidene]methyl]quinolinium|3-[2-[(1-Benzyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-1,3-benzoselenazol-3-yl]propane-1-sulfonate|3-[2-[(1-benzyl-6-methoxyquinolin-1-ium-2-yl)methylidene]benzo[d][1,3]selenazol-1-yl]propane-1-sulfonate|Quinolinium, 6-methoxy-1-(phenylmethyl)-2-[[3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene]methyl]-, inner salt

Molecular Formula	C28H26N2O4SSe
Molecular Weight	566.0778 g/mol
LogP	3.66
Topological Polar Surface Area	82.67 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	8
Exact Mass	566.0778
Heavy Atoms	36
Complexity	1701.1

Chemical Identifiers

CAS Number	63816-07-9
SMILES	COC1=CC2=C(C=C1)[N+](=C(C=C2)C=C3N=C4C=CC=CC4=[Se]3CCCS(=O)(=O)[O-])CC5=CC=CC=C5