PROTAC PTPN2 degrader-2 TFA

Catalog No. :
ACKLKR385
CAS No. :
2912307-39-0
Molecular Formula :
C51H50ClF3N6O13S2
Molecular Weight :
1111.57

IUPAC Name:2,2,2-trifluoroacetic acid--3-(carboxymethoxy)-4-chloro-5-(3-(((S)-1-((3-(4-(1-((S)-2,6-dioxopiperidin-3-yl)-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)piperidine-1-carboxamido)benzyl)sulfonyl)-2,2-dimethylpiperidin-4-yl)amino)phenyl)thiophene-2-carboxylic acid (1/1)

PROTAC PTPN2 degrader-2 TFA structure diagram
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Product Information

Product NamePROTAC PTPN2 degrader-2 TFA
IUPAC Name2,2,2-trifluoroacetic acid--3-(carboxymethoxy)-4-chloro-5-(3-(((S)-1-((3-(4-(1-((S)-2,6-dioxopiperidin-3-yl)-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)piperidine-1-carboxamido)benzyl)sulfonyl)-2,2-dimethylpiperidin-4-yl)amino)phenyl)thiophene-2-carboxylic acid (1/1)
Molecular FormulaC51H50ClF3N6O13S2
Molecular Weight1111.57
SMILESO=C(O)C(F)(F)F.O=C(C1=C(OCC(O)=O)C(Cl)=C(C2=CC=CC(N[C@@H]3CC(C)(C)N(S(=O)(CC4=CC=CC(NC(N5CCC(C6=C7C8=C(N([C@@H](CC9)C(NC9=O)=O)C(C8=CC=C7)=O)C=C6)CC5)=O)=C4)=O)CC3)=C2)S1)O
InChI KeyRXQQQCZMVRJVJE-PRLOVNCOSA-N
SynonymPROTAC PTPN2 degrader-2 TFA;2-Thiophenecarboxylic acid, 3-(carboxymethoxy)-4-chloro-5-[3-[[(4S)-1-[[[3-[[[4-[1-[(3S)-2,6-dioxo-3-piperidinyl]-1,2-dihydro-2-oxobenz[cd]indol-6-yl]-1-piperidinyl]carbonyl]amino]phenyl]methyl]sulfonyl]-2,2-dimethyl-4-piperidinyl]amino]phenyl]-, 2,2,2-trifluoroacetate (1:1)
CAS No.2912307-39-0

Synthetic Route by SureRoute

1. ACKLKR385 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACKLKR385 route product structure diagram
    ACKLKR3852912307-39-0
Inquiry

2. ACKLKR385 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACKLKR385 route product structure diagram
    ACKLKR3852912307-39-0
Inquiry

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