O-Alkyl Brexpiprazole

About O-Alkyl Brexpiprazole

O-Alkyl Brexpiprazole is an impurity of Brexpiprazole carrying the CAS registry number 2116542-21-1. The compound has the formula C38H40N4O4S, corresponding to a molecular weight of 648.8 g/mol. The IUPAC name is 7-[4-[7-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butoxy]quinolin-2-yl]oxybutoxy]-1H-quinolin-2-one.

It is supplied as a solid. Reference materials should be stored sealed and away from light and moisture, as specified on the accompanying COA. Handle it with standard laboratory precautions and appropriate personal protective equipment.

As a characterised impurity of Brexpiprazole, it is used for analytical method development, method validation (AMV) and routine quality-control testing, and it supports ANDA and DMF regulatory filings. Typical end-use sectors are pharmaceutical manufacturing and academic and industrial research.

Standard pack sizes are 10 mg, 25 mg, 50 mg and 100 mg, and every batch ships with a Certificate of Analysis (COA) and we export worldwide.

Typical applications

Analytical method development
Method validation (AMV)
QC release testing
ANDA / DMF filings

Industries

Related to Brexpiprazole

View every impurity, metabolite and intermediate we list for Brexpiprazole.

Brexpiprazole impurities

Specifications & identifiers

Chemical identifiers
Product name	O-Alkyl Brexpiprazole
Catalogue No.	VQ-029494
CAS Number	2116542-21-1
IUPAC name	7-[4-[7-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butoxy]quinolin-2-yl]oxybutoxy]-1H-quinolin-2-one
Molecular formula	C₃₈H₄₀N₄O₄S
Molecular weight	648.8 g/mol
Exact mass	648.277
Grade	Reference Standard
HSN code	38229090
InChIKey	KVKIZAUWWJSARG-UHFFFAOYSA-N
SMILES	C1CN(CCN1CCCCOC2=CC3=C(C=C2)C=CC(=N3)OCCCCOC4=CC5=C(C=C4)C=CC(=O)N5)C6=C7C=CSC7=CC=C6
PubChem CID	132327608

Physical properties
Physical form	Solid
LogP (XLogP3)	7.6
H-bond donors / acceptors	1 / 8
TPSA	104 Å²

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of O-Alkyl Brexpiprazole?

The CAS Registry Number of O-Alkyl Brexpiprazole is 2116542-21-1. It is also known as O-[4-((2-Oxo-1,2-dihydroquinolin-7-yl)oxy)butyl] Brexpiprazole.

What is the molecular formula and molecular weight of O-Alkyl Brexpiprazole?

O-Alkyl Brexpiprazole has the molecular formula C38H40N4O4S and a molecular weight of 648.8 g/mol. Its IUPAC name is 7-[4-[7-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butoxy]quinolin-2-yl]oxybutoxy]-1H-quinolin-2-one.

What is O-Alkyl Brexpiprazole used for?

O-Alkyl Brexpiprazole is supplied as a characterised reference material related to Brexpiprazole. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of O-Alkyl Brexpiprazole can I order?

We supply O-Alkyl Brexpiprazole in Reference Standard grade, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with O-Alkyl Brexpiprazole?

Yes. Every lot of O-Alkyl Brexpiprazole is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can O-Alkyl Brexpiprazole be shipped internationally?

Yes. We export O-Alkyl Brexpiprazole worldwide by air and sea freight or express courier, on EXW, FOB, CIF, CFR or DAP Incoterms, with full export documentation.