PARP7-IN-12

Catalog No. :
ACJOCT686
CAS No. :
2819700-92-8
Molecular Formula :
C23H27ClF3N5O5
Molecular Weight :
545.95

IUPAC Name:5-(((S)-1-(3-((R)-3-chloro-4-methyl-6,7,7a,8,10,11-hexahydro-9H-pyrazino[1,2-d]pyrido[3,2-b][1,4]oxazepin-9-yl)-3-oxopropoxy)propan-2-yl)oxy)-4-(trifluoromethyl)pyridazin-3(2H)-one

PARP7-IN-12 structure diagram
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Product Information

Product NamePARP7-IN-12
IUPAC Name5-(((S)-1-(3-((R)-3-chloro-4-methyl-6,7,7a,8,10,11-hexahydro-9H-pyrazino[1,2-d]pyrido[3,2-b][1,4]oxazepin-9-yl)-3-oxopropoxy)propan-2-yl)oxy)-4-(trifluoromethyl)pyridazin-3(2H)-one
Molecular FormulaC23H27ClF3N5O5
Molecular Weight545.95
SMILESCC1=C2C(N3[C@@](CN(C(CCOC[C@@H](OC4=C(C(F)(F)F)C(=O)NN=C4)C)=O)CC3)(CCO2)[H])=NC=C1Cl
InChI KeyIKONORYVINLXHN-DZGCQCFKSA-N
Synonym3(2H)-Pyridazinone, 5-[(1S)-2-[3-[(7aR)-3-chloro-6,7,7a,8,10,11-hexahydro-4-methyl-9H-pyrazino[1,2-d]pyrido[3,2-b][1,4]oxazepin-9-yl]-3-oxopropoxy]-1-methylethoxy]-4-(trifluoromethyl)-;PARP7-IN-12
CAS No.2819700-92-8

Synthetic Route by SureRoute

1. ACJOCT686 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACJOCT686 route product structure diagram
    ACJOCT6862819700-92-8
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2. ACJOCT686 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACJOCT686 route product structure diagram
    ACJOCT6862819700-92-8
Inquiry

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