Indole, 1-(bis(3-(dimethylamino)propyl)amino)-3-(p-chlorophenyl)-5-fluoro-, dihydrochloride structure

Indole, 1-(bis(3-(dimethylamino)propyl)amino)-3-(p-chlorophenyl)-5-fluoro-, dihydrochloride

3-[[3-(4-chlorophenyl)-5-fluoroindol-1-yl]-[3-(dimethylazaniumyl)propyl]amino]propyl-dimethylazanium dichloride

CAS: 57647-58-2
Molecular Formula C24H34Cl3FN4
Molecular Weight 503.9 g/mol
Topological Polar Surface Area 17.1 A2
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 10
Exact Mass 502.18332
Heavy Atoms 32
Complexity 484.0

Chemical Identifiers

CAS Number 57647-58-2
SMILES C[NH+](C)CCCN(CCC[NH+](C)C)N1C=C(C2=C1C=CC(=C2)F)C3=CC=C(C=C3)Cl.[Cl-].[Cl-]
InChIKey PYLHNORZPJGKSK-UHFFFAOYSA-N

📖 Product Overview

Indole, 1-(bis(3-(dimethylamino)propyl)amino)-3-(p-chlorophenyl)-5-fluoro-, dihydrochloride (CAS: 57647-58-2) is a chemical compound with molecular formula C24H34Cl3FN4 and molecular weight 503.9 g/mol. Its IUPAC systematic name is 3-[[3-(4-chlorophenyl)-5-fluoroindol-1-yl]-[3-(dimethylazaniumyl)propyl]amino]propyl-dimethylazanium dichloride. Topological Polar Surface Area 17.1 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 10 Exact Mass 502.18332 Heavy Atoms 32 Complexity 484.0 InChI Key: PYLHNORZPJGKSK-UHFFFAOYSA-N. SMILES: C[NH+](C)CCCN(CCC[NH+](C)C)N1C=C(C2=C1C=CC(=C2)F)C3=CC=C(C=C3)Cl.[Cl-].[Cl-].

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