Products 1427049-21-5

CAS 1427049-21-5 appears in our catalog under these names: Brexpiprazole-d8, Brexpiprazole–d8, Brexpiprazole-d8, 99.90%. Offered by: Chemat Brand, TargetMol, GLPBio, Biosynth, MedChemExpress. Available pack sizes: on request, 1mg, 5mg, 500μg, 10mg, 500 μg, 5 mg, 1 mg.

Structural formula: {0} (CAS {1})

7-[4-[4-(1-benzothiophen-4-yl)-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl]butoxy]-1H-quinolin-2-one (CAS 1427049-21-5) is a chemical compound with the molecular formula C25H27N3O2S and a molecular weight of 441.6 g/mol. IUPAC name: 7-[4-[4-(1-benzothiophen-4-yl)-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl]butoxy]-1H-quinolin-2-one. InChIKey: ZKIAIYBUSXZPLP-DHNBGMNGSA-N.

Identity
Molecular formulaC25H27N3O2S
Molecular weight441.6 g/mol
IUPAC name7-[4-[4-(1-benzothiophen-4-yl)-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl]butoxy]-1H-quinolin-2-one
InChIKeyZKIAIYBUSXZPLP-DHNBGMNGSA-N
SMILES[2H]C1(C(N(C(C(N1CCCCOC2=CC3=C(C=C2)C=CC(=O)N3)([2H])[2H])([2H])[2H])C4=C5C=CSC5=CC=C4)([2H])[2H])[2H]

Computed by PubChem (NCBI)