RefChem:579974

copper;tetrasodium;7-[(5-chloro-6-fluoro-2-methylpyrimidin-4-yl)amino]-4-oxido-3-[(2-oxido-4,6-disulfonatonaphthalen-1-yl)diazenyl]naphthalene-1,5-disulfonate

Also Known As: Cuprate(4-), (7-((5-chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino)-4-(hydroxy-kappaO)-3-((2-(hydroxy-kappaO)-4,6-disulfo-1-naphthalenyl)azo-kappaN1)-1,5-naphthalenedisulfonato(6-))-, tetrasodium|7-((5-Chloro-2-fluoro-4-methylpyrimidin-6-yl)amino)-4-hydroxy-3-((2-hydroxy-4,6-disulfonaphthalen-1-yl)azo)-1,5-naphthalenedisulfonic acid, copper complex, tetrasodium salt|Cuprate(4-), (7-((5-chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino)-4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-4,6-disulfo-1-naphthalenyl)diazenyl-kappaN1)-1,5-naphthalenedisulfonato(6-))-, sodium (1:4)|7-((5-Chloro-2-fluoro-4-methylpyrimidin-6-yl)amino)-4-hydroxy-3-((2-hydroxy-4,6-disulfonaphthalen-1-yl)azo)-1,5-naphthalenedisulfonic acid, coppercomplex, tetrasodium salt|Copper Tetrasodium 7-[(5-Chloro-6-Fluoro-2-Methylpyrimidin-4-Yl)Amino]-4-Oxido-3-(2-Oxido-4,6-Disulfonatonaphthalen-1-Yl)Diazenylnaphthalene-1,5-Disulfonate|copper tetrasodium 7-[(5-chloro-6-fluoro-2-methylpyrimidin-4-yl)amino]-4-oxido-3-[(2-oxido-4,6-disulfonatonaphthalen-1-yl)diazenyl]naphthalene-1,5-disulfonate|Copper Tetrasodium 7-[(5-Chloro-6-Fluoro-2-Methylpyrimidin-4-ylAmino]-4-Oxido-3-(2-Oxido-4,6-Disulfonatonaphthalen-1-ylDiazenylnaphthalene-1,5-Disulfonate|copper,tetrasodium,7-[(5-chloro-6-fluoro-2-methylpyrimidin-4-yl)amino]-4-oxido-3-[(2-oxido-4,6-disulfonatonaphthalen-1-yl)diazenyl]naphthalene-1,5-disulfonate|Cuprate(4-), (7-((5-chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino)-4-hydroxy-3-((2-hydroxy-4,6-disulfo-1-naphthalenyl)azo)-1,5-naphthalenedisulfonato(6-))-, tetrasodium|Cuprate(4-), [7-[(5-chloro-2-fluoro-6- methyl-4-pyrimidinyl)amino]-4-hydroxy-3-[(2-hydroxy -4,6-disulfo-1-naphthalenyl)azo]-1,5-naphthalenedisulfonat o(6-)]-, tetrasodium|Cuprate(4-), [7-[(5-chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino]-4-(hydroxy-.kappa.O)-3-[[2-(hydroxy-.kappa.O)-4,6-disulfo-1-naphthalenyl]azo-.kappa.N1]-1,5-naphthalenedisulfonato(6-)]-, tetrasodium|Cuprate(4-), [7-[(5-chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino]-4-(hydroxy-.kappa.O)-3-[2-[2-(hydroxy-.kappa.O)-4,6-disulfo-1-naphthalenyl]diazenyl-.kappa.N1]-1,5-naphthalenedisulfonato(6-)]-, sodium (1:4)|Cuprate(4-), [7-[(5-chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino]-4-(hydroxy-kappaO)-3-[2-[2-(hydroxy-kappaO)-4,6-disulfo-1-naphthalenyl]diazenyl-kappaN1]-1,5-naphthalenedisulfonato(6-)]-, sodium (1:4)|Cuprate(4-), [7-[(5-chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino]-4-hydroxy-3-[(2-hydroxy-4,6-disulfo-1-naphthalenyl)azo]-1,5-naphthalenedisulfonato(6-)]-, tetrasodium

Molecular Formula	C25H11ClCuFN5Na4O14S4
Molecular Weight	941.7745 g/mol
LogP	-10.17998
Topological Polar Surface Area	371.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	20
Rotatable Bonds	4
Exact Mass	941.7745
Monoisotopic Mass	941.7745
Heavy Atoms	55
Complexity	1670.0

Chemical Identifiers

CAS Number	75199-10-9
SMILES	CC1=NC(=C(C(=N1)F)Cl)NC2=CC3=C(C=C(C(=C3C(=C2)S(=O)(=O)[O-])[O-])N=NC4=C5C=CC(=CC5=C(C=C4[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]
InChIKey	KCTMVHKBTVHYRI-UHFFFAOYSA-H