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N-[7-Butoxyquinolin-2(1H)-one] Brexpiprazole Iodide, TRC

Product Code. 30334048
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Product Code. 30334048 Supplier Toronto Research Chemicals Supplier No. TRCB67741050MG

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Description

High-purity organic molecules and analytical standards, strategically delivered worldwide to empower innovation and commercial success.

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Specifications

Chemical Name or Material N-[7-Butoxyquinolin-2(1H)-one] Brexpiprazole Iodide
Analyte or Component Names N-[7-Butoxyquinolin-2(1H)-one] Brexpiprazole Iodide
Shipping Condition Room Temperature
Molecular Formula C38H41N4O4S • I
Synonym 4-(Benzo[b]thiophen-4-yl)-1,1-bis(4-((2-oxo-1,2-dihydroquinolin-7-yl)oxy)butyl)piperazin-1-ium Iodide
InChI Formula InChI=1S/C38H40N4O4S.HI/c43-37-14-10-28-8-12-30(26-33(28)39-37)45-23-3-1-19-42(21-17-41(18-22-42)35-6-5-7-36-32(35)16-25-47-36)20-2-4-24-46-31-13-9-29-11-15-38(44)40-34(29)27-31;/h5-16,25-27H,1-4,17-24H2,(H-,39,40,43,44);1H
Solution Type Neat
SMILES O=C1NC2=C(C=CC(OCCCC[N+]3(CCCCOC4=CC5=C(C=C4)C=CC(N5)=O)CCN(C6=C(C=CS7)C7=CC=C6)CC3)=C2)C=C1.[I-]
IUPAC Name 4-(benzo[b]thiophen-4-yl)-1,1-bis(4-((2-oxo-1,2-dihydroquinolin-7-yl)oxy)butyl)piperazin-1-ium iodide
Industry Type Pharmaceutical
Molecular Weight (g/mol) 776.73
Quantity 50 mg
Formula Weight 776.19
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