Compound C38H37Cl2N5O2S

acridin-9-yl-[4-[6-(acridin-9-ylazaniumyl)hexylsulfonylamino]phenyl]azanium dichloride

CAS: 66725-12-0

Molecular Formula	`C38H37Cl2N5O2S`
Molecular Weight	698.7 g/mol
Topological Polar Surface Area	114.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	7
Rotatable Bonds	12
Exact Mass	697.2045
Heavy Atoms	48
Complexity	1000.0

Chemical Identifiers

CAS Number	66725-12-0
SMILES	`C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)[NH2+]CCCCCCS(=O)(=O)NC4=CC=C(C=C4)[NH2+]C5=C6C=CC=CC6=NC7=CC=CC=C75.[Cl-].[Cl-]`
InChIKey	`IBELXWIDZZSJSO-UHFFFAOYSA-N`

📖 Product Overview

Compound C38H37Cl2N5O2S (CAS: 66725-12-0) is a chemical compound with molecular formula C38H37Cl2N5O2S and molecular weight 698.7 g/mol. Its IUPAC systematic name is acridin-9-yl-[4-[6-(acridin-9-ylazaniumyl)hexylsulfonylamino]phenyl]azanium dichloride. Topological Polar Surface Area 114.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 7 Rotatable Bonds 12 Exact Mass 697.2045 Heavy Atoms 48 Complexity 1000.0 InChI Key: IBELXWIDZZSJSO-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)[NH2+]CCCCCCS(=O)(=O)NC4=CC=C(C=C4)[NH2+]C5=C6C=CC=CC6=NC7=CC=CC=C75.[Cl-].[Cl-].

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