Compound C26H42Cl2N2O2S2

4-(4-methoxyphenyl)butyl-[2-[2-[4-(4-methoxyphenyl)butylazaniumyl]ethyldisulfanyl]ethyl]azanium dichloride

CAS: 36894-65-2

Molecular Formula	`C26H42Cl2N2O2S2`
Molecular Weight	549.7 g/mol
Topological Polar Surface Area	102.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	19
Exact Mass	548.2065
Heavy Atoms	34
Complexity	377.0

Chemical Identifiers

CAS Number	36894-65-2
SMILES	`COC1=CC=C(C=C1)CCCC[NH2+]CCSSCC[NH2+]CCCCC2=CC=C(C=C2)OC.[Cl-].[Cl-]`
InChIKey	`DFAXIWKIBAGXSH-UHFFFAOYSA-N`

📖 Product Overview

Compound C26H42Cl2N2O2S2 (CAS: 36894-65-2) is a chemical compound with molecular formula C26H42Cl2N2O2S2 and molecular weight 549.7 g/mol. Its IUPAC systematic name is 4-(4-methoxyphenyl)butyl-[2-[2-[4-(4-methoxyphenyl)butylazaniumyl]ethyldisulfanyl]ethyl]azanium dichloride. Topological Polar Surface Area 102.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 19 Exact Mass 548.2065 Heavy Atoms 34 Complexity 377.0 InChI Key: DFAXIWKIBAGXSH-UHFFFAOYSA-N. SMILES: COC1=CC=C(C=C1)CCCC[NH2+]CCSSCC[NH2+]CCCCC2=CC=C(C=C2)OC.[Cl-].[Cl-].

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