Fuzuloparib
4-[[4-fluoro-3-[2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl]phenyl]methyl]-2H-phthalazin-1-one
Molecular Identity
Fuzuloparib
4-[[4-fluoro-3-[2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl]phenyl]methyl]-2H-phthalazin-1-one
PubChem CID: 56649297
2D Structure
Properties
C22H16F4N6O2
Molecular Formula
472.40
Molecular Weight
g/mol
472.1271
Exact Mass
Da
2.4
XLogP
Drug-like (Lipinski: < 5)
92.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
9
H-Bond Acceptors
839
Complexity
SMILES
Canonical SMILES
SMILES: C1CN2C(=NC(=N2)C(F)(F)F)CN1C(=O)C3=C(C=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54)FIsomeric SMILES
SMILES: C1CN2C(=NC(=N2)C(F)(F)F)CN1C(=O)C3=C(C=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54)FSynonyms(20)
Fluzoparib1358715-18-0FuzuopaliFuzuloparibSHR3162SHR-3162TWF0ML1CK84-[[4-fluoro-3-[2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl]phenyl]methyl]-2H-phthalazin-1-oneHS10160HS-101601(2H)-Phthalazinone, 4-((3-((5,6-dihydro-2-(trifluoromethyl)(1,2,4)triazolo(1,5-a)pyrazin-7(8H)-yl)carbonyl)-4-fluorophenyl)methyl)-4-((3-((5,6-Dihydro-2-(trifluoromethyl)(1,2,4)triazolo(1,5-a)pyrazin-7(8H)-yl)carbonyl)-4-fluorophenyl)methyl)-1(2H)-phthalazinoneAiRuiYi4-((4-fluoro-3-(2-(trifluoromethyl)-6,8-dihydro-5H-(1,2,4)triazolo(1,5-a)pyrazine-7-carbonyl)phenyl)methyl)-2H-phthalazin-1-oneRefChem:141090
Data from PubChem (NCBI)
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