PAD4-IN-2

Catalog No. :
ACPCKB385
CAS No. :
2642327-52-2
Molecular Formula :
C20H23BClN7O6
Molecular Weight :
503.71

IUPAC Name:(S)-(3-((5-(2-chloroacetimidamido)-2-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)pentanamido)methyl)phenyl)boronic acid

PAD4-IN-2 structure diagram
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Product Information

Product NamePAD4-IN-2
IUPAC Name(S)-(3-((5-(2-chloroacetimidamido)-2-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)pentanamido)methyl)phenyl)boronic acid
Molecular FormulaC20H23BClN7O6
Molecular Weight503.71
SMILESN=C(CCl)NCCC[C@H](NC1=CC=C([N+](=O)[O-])C2=NON=C12)C(=O)NCC1=CC(B(O)O)=CC=C1
InChI KeyLVPRLUILJALGIP-HNNXBMFYSA-N
SynonymPAD4-IN-2;Boronic acid, B-[3-[[[(2S)-5-[(2-chloro-1-iminoethyl)amino]-2-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-1-oxopentyl]amino]methyl]phenyl]-
CAS No.2642327-52-2

Synthetic Route by SureRoute

1. ACPCKB385 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. ACPCKB385 route product structure diagram
    ACPCKB3852642327-52-2
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2. ACPCKB385 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACJSFV723 route compound structure diagram
    ACJSFV72310199-89-0 In Stock
  4. Then
  5. ACPCKB385 route product structure diagram
    ACPCKB3852642327-52-2
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