Products 2819999-00-1

CAS 2819999-00-1 is the registry number for PARP7-IN-18. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

4-[(2S)-2-[[3-[(11S)-5-chloro-8-oxa-1,3,13-triazatricyclo[9.4.0.02,7]pentadeca-2(7),3,5-trien-13-yl]-3-oxopropoxy]methyl]azetidin-1-yl]-5-(trifluoromethyl)-1H-pyridazin-6-one (CAS 2819999-00-1) is a chemical compound with the molecular formula C23H26ClF3N6O4 and a molecular weight of 542.9 g/mol. IUPAC name: 4-[(2S)-2-[[3-[(11S)-5-chloro-8-oxa-1,3,13-triazatricyclo[9.4.0.02,7]pentadeca-2(7),3,5-trien-13-yl]-3-oxopropoxy]methyl]azetidin-1-yl]-5-(trifluoromethyl)-1H-pyridazin-6-one. InChIKey: YSVWRWHSYZIFDS-HOTGVXAUSA-N.

Identity
Molecular formulaC23H26ClF3N6O4
Molecular weight542.9 g/mol
IUPAC name4-[(2S)-2-[[3-[(11S)-5-chloro-8-oxa-1,3,13-triazatricyclo[9.4.0.02,7]pentadeca-2(7),3,5-trien-13-yl]-3-oxopropoxy]methyl]azetidin-1-yl]-5-(trifluoromethyl)-1H-pyridazin-6-one
InChIKeyYSVWRWHSYZIFDS-HOTGVXAUSA-N
SMILESC1CN([C@@H]1COCCC(=O)N2CCN3[C@H](C2)CCOC4=C3N=CC(=C4)Cl)C5=C(C(=O)NN=C5)C(F)(F)F

Computed by PubChem (NCBI)

Synonyms: orb2565577