EINECS 306-838-6

3-[[4-[4-(benzenesulfonyloxy)butan-2-ylamino]-9,10-dioxoanthracen-1-yl]amino]butyl benzenesulfonate

Also Known As: ((9,10-Dihydro-9,10-dioxo-1,4-anthrylene)bis(imino(3-methylpropane-1,3-diyl)))bis(benzenesulphonic) acid|1,4-bis[4-(benzenesulfonyloxy)butan-2-ylamino]anthracene-9,10-dione|[(9,10-dihydro-9,10-dioxo-1,4-anthrylene)bis[imino(3-methylpropane-1,3-diyl)]]bis(benzenesulphonic) acid|[(9,10-Dioxo-9,10-dihydroanthracene-1,4-diyl)bis(azanediyl)butane-3,1-diyl] dibenzenesulfonate|3-[[4-[4-(benzenesulfonyloxy)butan-2-ylamino]-9,10-dioxoanthracen-1-yl]amino]butyl benzenesulfonate

Molecular Formula	C34H34N2O8S2
Molecular Weight	662.17566 g/mol
LogP	7.5
Topological Polar Surface Area	162.0 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	10
Rotatable Bonds	14
Exact Mass	662.17566
Monoisotopic Mass	662.17566
Heavy Atoms	46
Complexity	1140.0

Chemical Identifiers

CAS Number	97416-89-2
SMILES	CC(CCOS(=O)(=O)C1=CC=CC=C1)NC2=C3C(=C(C=C2)NC(C)CCOS(=O)(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=O
InChIKey	BJGLTAKAJLZVQF-UHFFFAOYSA-N