Belvarafenib
4-amino-N-[1-(3-chloro-2-fluoroanilino)-6-methylisoquinolin-5-yl]thieno[3,2-d]pyrimidine-7-carboxamide
Molecular Identity
Belvarafenib
4-amino-N-[1-(3-chloro-2-fluoroanilino)-6-methylisoquinolin-5-yl]thieno[3,2-d]pyrimidine-7-carboxamide
PubChem CID: 89655386
2D Structure
Properties
C23H16ClFN6OS
Molecular Formula
478.90
Molecular Weight
g/mol
478.0779
Exact Mass
Da
4.9
XLogP
Drug-like (Lipinski: < 5)
134
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
8
H-Bond Acceptors
708
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Belvarafenib1446113-23-04-Amino-N-(1-((3-chloro-2-fluorophenyl)amino)-6-methylisoquinolin-5-yl)thieno[3,2-d]pyrimidine-7-carboxamide31M3WLJ3KG4-amino-N-[1-(3-chloro-2-fluoroanilino)-6-methylisoquinolin-5-yl]thieno[3,2-d]pyrimidine-7-carboxamideBELVARAFENIB [INN]UNII-31M3WLJ3KGHM95573BELVARAFENIB [WHO-DD]RG6185Example 116 [WO2013100632A1]4-amino-N-{1-[(3-chloro-2-fluorophenyl)amino]-6-methylisoquinolin-5-yl}thieno[3,2-d]pyrimidine-7-carboxamide4-AMINO-N-(1-((3-CHLORO-2-FLUOROPHENYL)AMINO)-6-METHYLISOQUINOLIN-5-YL)THIENO(3,2-D)PYRIMIDINE-7-CARBOXAMIDETHIENO(3,2-D)PYRIMIDINE-7-CARBOXAMIDE, 4-AMINO-N-(1-((3-CHLORO-2-FLUOROPHENYL)AMINO)-6-METHYL-5-ISOQUINOLINYL)-Example 116 (WO2013100632A1)
Data from PubChem (NCBI)
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