2-fluoro-N-(1-(2-(((2-((((3R,4R)-3-hydroxypiperidin-4-yl)methyl)amino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-4-yl)amino)methyl)phenyl)isoquinolin-6-yl)acrylamide

Catalog No. :
ACBUFI542
CAS No. :
2766124-39-2
Molecular Formula :
C33H36FN9O2
Molecular Weight :
609.71

IUPAC Name:2-fluoro-N-(1-(2-(((2-((((3R,4R)-3-hydroxypiperidin-4-yl)methyl)amino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-4-yl)amino)methyl)phenyl)isoquinolin-6-yl)acrylamide

2-fluoro-N-(1-(2-(((2-((((3R,4R)-3-hydroxypiperidin-4-yl)methyl)amino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-4-yl)amino)methyl)phenyl)isoquinolin-6-yl)acrylamide structure diagram
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Product Information

Product Name2-fluoro-N-(1-(2-(((2-((((3R,4R)-3-hydroxypiperidin-4-yl)methyl)amino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-4-yl)amino)methyl)phenyl)isoquinolin-6-yl)acrylamide
IUPAC Name2-fluoro-N-(1-(2-(((2-((((3R,4R)-3-hydroxypiperidin-4-yl)methyl)amino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-4-yl)amino)methyl)phenyl)isoquinolin-6-yl)acrylamide
Molecular FormulaC33H36FN9O2
Molecular Weight609.71
SMILESC=C(F)C(NC1=CC2=C(C(C3=CC=CC=C3CNC4=NC(NC[C@@H]5[C@@H](O)CNCC5)=NC6=C(C(C)C)C=NN64)=NC=C2)C=C1)=O
InChI KeyPDKSTEKFCWNJFC-LXFBAYGMSA-N
Synonym2-Fluoro-N-[1-[2-[[[2-[[[(3R,4R)-3-hydroxy-4-piperidinyl]methyl]amino]-8-(1-methylethyl)pyrazolo[1,5-a]-1,3,5-triazin-4-yl]amino]methyl]phenyl]-6-isoquinolinyl]-2-propenamide;CDK7-IN-21 (compound A22)
CAS No.2766124-39-2

Synthetic Route by SureRoute

1. ACBUFI542 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACBUFI542 route product structure diagram
    ACBUFI5422766124-39-2
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2. ACBUFI542 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACBUFI542 route product structure diagram
    ACBUFI5422766124-39-2
Inquiry

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