Products 1551355-46-4

CAS 1551355-46-4 appears in our catalog under these names: Simmiparib/ 99.51% (existing batch purity), Simmiparib, Simmiparib, 99.01%. Offered by: TargetMol, GLPBio, Chemat, MedChemExpress. Available pack sizes: 1mg, 25mg, 50mg, 100mg, 10mg, 5mg, 200mg, 5 mg.

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

4-[[4-fluoro-3-[5-methyl-3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl]phenyl]methyl]-2H-phthalazin-1-one (CAS 1551355-46-4) is a chemical compound with the molecular formula C23H18F4N6O2 and a molecular weight of 486.4 g/mol. IUPAC name: 4-[[4-fluoro-3-[5-methyl-3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl]phenyl]methyl]-2H-phthalazin-1-one. InChIKey: QNQFPYADHVFRKQ-UHFFFAOYSA-N.

Identity
Molecular formulaC23H18F4N6O2
Molecular weight486.4 g/mol
IUPAC name4-[[4-fluoro-3-[5-methyl-3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl]phenyl]methyl]-2H-phthalazin-1-one
InChIKeyQNQFPYADHVFRKQ-UHFFFAOYSA-N
SMILESCC1CN(CC2=NN=C(N12)C(F)(F)F)C(=O)C3=C(C=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54)F

Computed by PubChem (NCBI)