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1432500-66-7
Catalog No.:AA01ENIK

1432500-66-7 | (1S,2R)-2-[[(1S)-1-[(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl]-3,4-dihydro-2(1H)-isoquinolinyl]carbonyl]cyclohexanecarboxylicacid

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1mg
≥98%
in stock  
$53.00   $37.00
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5mg
≥98%
in stock  
$230.00   $161.00
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10mg
≥98%
in stock  
$380.00   $266.00
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA01ENIK
Chemical Name:
(1S,2R)-2-[[(1S)-1-[(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl]-3,4-dihydro-2(1H)-isoquinolinyl]carbonyl]cyclohexanecarboxylicacid
CAS Number:
1432500-66-7
Molecular Formula:
C26H26N2O5
Molecular Weight:
446.4950
SMILES:
OC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCc2c([C@H]1CN1C(=O)c3c(C1=O)cccc3)cccc2
Properties
Computed Properties
 
Complexity:
789  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
3  

Literature

Title: Structure-Activity and Structure-Property Relationship and Exploratory in Vivo Evaluation of the Nanomolar Keap1-Nrf2 Protein-Protein Interaction Inhibitor.

Journal: Journal of medicinal chemistry 20150827

Title: Activation of NRF2 Signaling in HEK293 Cells by a First-in-Class Direct KEAP1-NRF2 Inhibitor.

Journal: Journal of biochemical and molecular toxicology 20150601

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SDS
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Tags:1432500-66-7 Molecular Formula|1432500-66-7 MDL|1432500-66-7 SMILES|1432500-66-7 (1S,2R)-2-[[(1S)-1-[(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl]-3,4-dihydro-2(1H)-isoquinolinyl]carbonyl]cyclohexanecarboxylicacid