BLU-945
N-[2-[(3S,4R)-3-fluoro-4-methoxypiperidin-1-yl]pyrimidin-4-yl]-8-[(2R,3S)-2-methyl-3-(methylsulfonylmethyl)azetidin-1-yl]-5-propan-2-ylisoquinolin-3-amine
Molecular Identity
BLU-945
N-[2-[(3S,4R)-3-fluoro-4-methoxypiperidin-1-yl]pyrimidin-4-yl]-8-[(2R,3S)-2-methyl-3-(methylsulfonylmethyl)azetidin-1-yl]-5-propan-2-ylisoquinolin-3-amine
PubChem CID: 156538665
2D Structure
Properties
C28H37FN6O3S
Molecular Formula
556.70
Molecular Weight
g/mol
556.2632
Exact Mass
Da
4.6
XLogP
Drug-like (Lipinski: < 5)
109
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
10
H-Bond Acceptors
921
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
BLU-9452660250-10-0BLU945TigozertinibPA4PTH5HL9Egfr mutant-selective inhibitor BLU-945BLU 945N-[2-[(3S,4R)-3-fluoro-4-methoxypiperidin-1-yl]pyrimidin-4-yl]-8-[(2R,3S)-2-methyl-3-(methylsulfonylmethyl)azetidin-1-yl]-5-propan-2-ylisoquinolin-3-amineN-(2-((3S,4R)-3-fluoro-4-methoxypiperidin-1-yl)pyrimidin-4-yl)-8-((2R,3S)-2-methyl-3-(methylsulfonylmethyl)azetidin-1-yl)-5-propan-2-ylisoquinolin-3-amineRefChem:1100118EGFR Inhibitor BLU-945UNII-PA4PTH5HL9N-(2-((3S,4R)-3-Fluoro-4-methoxypiperidin-1-yl)pyrimidin-4-yl)-5-isopropyl-8-((2R,3S)-2-methyl-3-((methylsulfonyl)methyl)azetidin-1-yl)isoquinolin-3-amineTigozertinib (USAN)TIGOZERTINIB [USAN]
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to BLU-945
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