Brexpiprazole Impurity 31

cas: 2116542-21-1 — see every product listed under this CAS number, including other names

Brexpiprazole Impurity 31 (CAS 2116542-21-1) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULB115035
cas2116542-21-1
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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purityNo data
categoryChemicals
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

7-[4-[7-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butoxy]quinolin-2-yl]oxybutoxy]-1H-quinolin-2-one (CAS 2116542-21-1) is a chemical compound with the molecular formula C38H40N4O4S and a molecular weight of 648.8 g/mol. IUPAC name: 7-[4-[7-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butoxy]quinolin-2-yl]oxybutoxy]-1H-quinolin-2-one. InChIKey: KVKIZAUWWJSARG-UHFFFAOYSA-N.

Identity
Molecular formulaC38H40N4O4S
Molecular weight648.8 g/mol
IUPAC name7-[4-[7-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butoxy]quinolin-2-yl]oxybutoxy]-1H-quinolin-2-one
InChIKeyKVKIZAUWWJSARG-UHFFFAOYSA-N
SMILESC1CN(CCN1CCCCOC2=CC3=C(C=C2)C=CC(=N3)OCCCCOC4=CC5=C(C=C4)C=CC(=O)N5)C6=C7C=CSC7=CC=C6

Computed by PubChem (NCBI)

Synonyms: Brexpiprazole Impurity 32, O-[4-((2-Oxo-1,2-dihydroquinolin-7-yl)oxy)butyl] Brexpiprazole (>90%), O-Alkyl Brexpiprazole
Isomers (same molecular formula)
7-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butoxy]-1-[4-[(2-oxo-1H-quinolin-7-yl)oxy]butyl]quinolin-2-one C38H40N4O4S

Also listed as

7-{4-[(7-{4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butoxy}quinolin-2-yl)oxy]butoxy}-1,2-dihydroquinolin-2-one, 95% Chemat Brand CAS 2116542-21-1
7-{4-((7-{4-(4-(1-Benzothiophen-4-yl)piperazin-1-yl)butoxy}quinolin-2-yl)oxy)butoxy}-1,2-dihydroquinolin-2-one Biosynth CAS 2116542-21-1