2-Indolinone, 1-(benzylmethylamino)-3-phenyl-3-(4-piperidinobutyl)-, monohydrochloride

1-[benzyl(methyl)amino]-3-phenyl-3-(4-piperidin-1-ium-1-ylbutyl)indol-2-one chloride

CAS: 40714-36-1

Molecular Formula	`C31H38ClN3O`
Molecular Weight	504.1 g/mol
Topological Polar Surface Area	28.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	9
Exact Mass	503.27036
Heavy Atoms	36
Complexity	664.0

Chemical Identifiers

CAS Number	40714-36-1
SMILES	`CN(CC1=CC=CC=C1)N2C3=CC=CC=C3C(C2=O)(CCCC[NH+]4CCCCC4)C5=CC=CC=C5.[Cl-]`
InChIKey	`DCVPWYPHVDVMDQ-UHFFFAOYSA-N`

📖 Product Overview

2-Indolinone, 1-(benzylmethylamino)-3-phenyl-3-(4-piperidinobutyl)-, monohydrochloride (CAS: 40714-36-1) is a chemical compound with molecular formula C31H38ClN3O and molecular weight 504.1 g/mol. Its IUPAC systematic name is 1-[benzyl(methyl)amino]-3-phenyl-3-(4-piperidin-1-ium-1-ylbutyl)indol-2-one chloride. Topological Polar Surface Area 28.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 9 Exact Mass 503.27036 Heavy Atoms 36 Complexity 664.0 InChI Key: DCVPWYPHVDVMDQ-UHFFFAOYSA-N. SMILES: CN(CC1=CC=CC=C1)N2C3=CC=CC=C3C(C2=O)(CCCC[NH+]4CCCCC4)C5=CC=CC=C5.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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