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Home Indole and Oxindoles 1233339-22-4
1233339-22-4,MFCD25976730
Catalog No.:AA000KAJ

1233339-22-4 | 4-[4-(1-Methanesulfonylcyclopropyl)-6-[(3R)-3-methylmorpholin-4-yl]pyrimidin-2-yl]-1H-indole

Pack Size
Purity
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Price(USD)
Quantity
  
1mg
≥98%
in stock  
$38.00   $26.00
- +
5mg
≥98%
in stock  
$83.00   $58.00
- +
10mg
≥98%
in stock  
$146.00   $102.00
- +
25mg
95%
in stock  
$300.00   $210.00
- +
100mg
95%
in stock  
$760.00   $532.00
- +
1000mg
98% by HPLC
in stock  
$6,295.00   $4,407.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000KAJ
Chemical Name:
4-[4-(1-Methanesulfonylcyclopropyl)-6-[(3R)-3-methylmorpholin-4-yl]pyrimidin-2-yl]-1H-indole
CAS Number:
1233339-22-4
Molecular Formula:
C21H24N4O3S
Molecular Weight:
412.5053
MDL Number:
MFCD25976730
SMILES:
C[C@@H]1COCCN1c1cc(nc(n1)c1cccc2c1cc[nH]2)C1(CC1)S(=O)(=O)C
Properties
Computed Properties
 
Complexity:
707  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
2.1  

Upstream Synthesis Route

[1]Patent:WO2010/73034,2010,A1,.Locationinpatent:Page/Pagecolumn68-69

[2]JournalofMedicinalChemistry,2013,vol.56,#5,p.2125-2138

[1]Chem,2018,vol.4,#3,p.522-532

[1]JournalofMedicinalChemistry,2013,vol.56,#5,p.2125-2138

[2]Chem,2018,vol.4,#3,p.522-532

[1]JournalofMedicinalChemistry,2013,vol.56,#5,p.2125-2138

[1]JournalofMedicinalChemistry,2013,vol.56,#5,p.2125-2138

Literature

Title: Discovery of 4-{4-[(3R)-3-Methylmorpholin-4-yl]-6-[1-(methylsulfonyl)cyclopropyl]pyrimidin-2-yl}-1H-indole (AZ20): a potent and selective inhibitor of ATR protein kinase with monotherapy in vivo antitumor activity.

Journal: Journal of medicinal chemistry 20130314

Title: Foote KM, et al. Discovery of 4-{4-[(3R)-3-Methylmorpholin-4-yl-6--(methylsulfonyl)cyclopropylpyrimidin-2-yl}-1H-indole (AZ20): a potent and selective inhibitor of ATR protein kinase with monotherapy in vivo antitumor activity. J Med Chem. 2013 Mar 14

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Tags:1233339-22-4 Molecular Formula|1233339-22-4 MDL|1233339-22-4 SMILES|1233339-22-4 4-[4-(1-Methanesulfonylcyclopropyl)-6-[(3R)-3-methylmorpholin-4-yl]pyrimidin-2-yl]-1H-indole