Compound C44H40N6O6S2

N,N'-bis[4-(acridin-9-ylamino)-3-methoxyphenyl]butane-1,4-disulfonamide

CAS: 66725-18-6

Molecular Formula	`C44H40N6O6S2`
Molecular Weight	813.0 g/mol
LogP	8.5
Topological Polar Surface Area	177.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	12
Rotatable Bonds	15
Exact Mass	812.24506
Heavy Atoms	58
Complexity	1370.0

Chemical Identifiers

CAS Number	66725-18-6
SMILES	`COC1=C(C=CC(=C1)NS(=O)(=O)CCCCS(=O)(=O)NC2=CC(=C(C=C2)NC3=C4C=CC=CC4=NC5=CC=CC=C53)OC)NC6=C7C=CC=CC7=NC8=CC=CC=C86`
InChIKey	`SJIPVTVPMMWEEW-UHFFFAOYSA-N`

📖 Product Overview

Compound C44H40N6O6S2 (CAS: 66725-18-6) is a chemical compound with molecular formula C44H40N6O6S2 and molecular weight 813.0 g/mol. Its IUPAC systematic name is N,N'-bis[4-(acridin-9-ylamino)-3-methoxyphenyl]butane-1,4-disulfonamide. LogP 8.5 Topological Polar Surface Area 177.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 12 Rotatable Bonds 15 Exact Mass 812.24506 Heavy Atoms 58 Complexity 1370.0 InChI Key: SJIPVTVPMMWEEW-UHFFFAOYSA-N. SMILES: COC1=C(C=CC(=C1)NS(=O)(=O)CCCCS(=O)(=O)NC2=CC(=C(C=C2)NC3=C4C=CC=CC4=NC5=CC=CC=C53)OC)NC6=C7C=CC=CC7=NC8=CC=CC=C86.

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