RefChem:79862

dilithium;2-[6-(6-methyl-7-sulfonato-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxoindene-5-carboxylate

Also Known As: Dilithium 2-(6-(6-methyl-7-sulphonatobenzothiazol-2-yl)-2-quinolyl)-1,3-dioxoindan-5-carboxylate|1H-Indene-5-carboxylic acid, 2,3-dihydro-2-(6-(6-methyl-7-sulfo-2-benzothiazolyl)-2-quinolinyl)-1,3-dioxo-, dilithium salt|1H-Indene-5-carboxylic acid, 2,3-dihydro-2-(6-(6-methyl-7-sulfo-2-benzothiazolyl)-2-quinolinyl)-1,3-dioxo-, lithium salt (1:2)|5-Indancarboxylic acid, 2-(6-(6-methyl-7-sulfo-2-benzothiazolyl)-2-quinolyl)-1,3-dioxo-, dilithium salt|dilithium2-[6- -2-quinolyl]-1,3-dioxoindan-5-carboxylate|1H-Indene-5-carboxylic acid, 2,3-dihydro-2-[6-(6-methyl-7-sulfo-2-benzothiazolyl)-2-quinolinyl]-1,3-dioxo-, dilithium salt|1H-Indene-5-carboxylic acid, 2,3-dihydro-2-[6-(6-methyl-7-sulfo-2-benzothiazolyl)-2-quinolinyl]-1,3-dioxo-, lithium salt (1:2)|2,3-Dihydro-2-[6-(6-methyl-7-sulfobenzothiazol-2-yl)quinolin-2-yl]-1,3-dioxo-1H-indene-5-carboxylic acid dilithium salt|Dilithium 2-[6-(6-methyl-7-sulfonato-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylate|dilithium 2-[6-(6-methyl-7-sulfonato-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxoindene-5-carboxylate|Dilithium 2-[6-(6-methyl-7-sulfonatobenzothiazol-2-yl)-2-quinolyl]-1,3-dioxoindan-5-carboxylate

Molecular Formula	C27H14Li2N2O7S2
Molecular Weight	556.0563 g/mol
LogP	-2.74168
Topological Polar Surface Area	194.0 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	10
Rotatable Bonds	2
Exact Mass	556.0563
Monoisotopic Mass	556.0563
Heavy Atoms	40
Complexity	1070.0

Chemical Identifiers

CAS Number	65151-69-1
SMILES	[Li+].[Li+].CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)[O-])S(=O)(=O)[O-]
InChIKey	BQVMZVAZYJYEJS-UHFFFAOYSA-L