RefChem:465328

1-amino-4-[2-methoxy-5-(2-sulfooxyethylsulfonyl)anilino]-9,10-dioxoanthracene-2-sulfonic acid

Also Known As: 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[2-methoxy-5-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-9,10-dioxo-|1-amino-4-[2-methoxy-5-(2-sulfooxyethylsulfonyl)anilino]-9,10-dioxoanthracene-2-sulfonic acid|2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((2-methoxy-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)amino)-9,10-dioxo-|1-amino-4-[(2-methoxy-5-{[2-(sulfooxy)ethyl]sulfonyl}phenyl)amino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid|1-Amino-9,10-dihydro-4-[[2-methoxy-5-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-9,10-dioxo-2-anthrac|1-amino-4-((2-methoxy-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)amino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid|1-AMINO-4-({2-METHOXY-5-[2-(SULFOOXY)ETHANESULFONYL]PHENYL}AMINO)-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-SULFONIC ACID|1-Amino-4-{2-methoxy-5-[2-(sulfooxy)ethanesulfonyl]anilino}-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid|1-Amino-9,10-dihydro-4-[[2-methoxy-5-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]amino]-9,10-dioxo-2-anthracenesulfonic acid|2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[5-[(2-hydroxyethyl)sulfonyl]-o-anisidino]-9,10-dioxo-, hydrogen sulfate (ester)|5-[2-(1,3-Diethyl-1,3-dihydro-benzoimidazol-2-ylidene)-eth-(Z)-ylidene]-3-ethyl-2-thioxo-thiazolidin-4-one

Molecular Formula	C23H20N2O12S3
Molecular Weight	612.0178 g/mol
LogP	1.64
Topological Polar Surface Area	233.53 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	12
Rotatable Bonds	9
Exact Mass	612.0178
Heavy Atoms	40
Complexity	1901.0

Chemical Identifiers

CAS Number	10150-26-2
SMILES	COC1=C(C=C(C=C1)S(=O)(=O)CCOS(=O)(=O)O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O