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1672665-49-4,MFCD28963916
Catalog No.:AA00ABM7

1672665-49-4 | PT-2385

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$27.00   $19.00
- +
5mg
98%
in stock  
$66.00   $47.00
- +
25mg
98%
in stock  
$168.00   $117.00
- +
50mg
98%
in stock  
$282.00   $198.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00ABM7
Chemical Name:
PT-2385
CAS Number:
1672665-49-4
Molecular Formula:
C17H12F3NO4S
Molecular Weight:
383.3417
MDL Number:
MFCD28963916
SMILES:
N#Cc1cc(cc(c1)F)Oc1ccc(c2c1CC(C2O)(F)F)S(=O)(=O)C
Properties
Computed Properties
 
Complexity:
686  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.4  

Downstream Synthesis Route

[1]CurrentPatentAssignee:MERCK&COINC-WO2015/35223,2015,A1Locationinpatent:Paragraph0948

[1]CurrentPatentAssignee:MERCK&COINC-WO2015/35223,2015,A1Locationinpatent:Paragraph0813

[2]CurrentPatentAssignee:MERCK&COINC-WO2016/145032,2016,A1Locationinpatent:Paragraph00507

[1]CurrentPatentAssignee:MERCK&COINC-WO2016/145236,2016,A1Locationinpatent:Paragraph0282-0283

[2]CurrentPatentAssignee:THEUNIVERSITYOFTEXASSYSTEM-WO2016/57242,2016,A1Locationinpatent:Paragraph0182;0183;0189

[3]CurrentPatentAssignee:MERCK&COINC-WO2016/145045,2016,A1Locationinpatent:Paragraph00462;00468

[4]CurrentPatentAssignee:MERCK&COINC-WO2019/191227,2019,A1Locationinpatent:Paragraph0253;0259

[5]CurrentPatentAssignee:CHINAPHARMACEUTICALUNIVERSITY-CN113651735,2021,ALocationinpatent:Paragraph0114-0120

[6]CurrentPatentAssignee:MERCK&COINC-US2018/140569,2018,A1Locationinpatent:Paragraph0814;0820

1672665-49-4    108-24-7   
CASUnavailable 

[1]Xu,Rui;Wang,Keshi;Rizzi,JamesP.;Huang,Heli;Grina,JonasA.;Schlachter,StephenT.;Wang,Bin;Wehn,PaulM.;Yang,Hanbiao;Dixon,DarrylD.;Czerwinski,RobertM.;Du,Xinlin;Ged,EmilyL.;Han,Guangzhou;Tan,Huiling;Wong,Tai;Xie,Shanhai;Josey,JohnA.;Wallace,EliM.[JournalofMedicinalChemistry,2019,vol.62,#15,p.6876-6893]

Literature

Title: Eli Wallace, Ph.D. PT2385: HIF-2α Antagonist for the Treatment of VHL Mutant ccRCC. 12th International VHL Medical Symposium April 8, 2016.

Title: Xie C, et al. Activation of intestinal hypoxia-inducible factor 2α during obesity contributes to hepatic steatosis. Nat Med. 2017 Nov;23(11):1298-1308.

Title: Wallace EM, et al. A Small-Molecule Antagonist of HIF2α Is Efficacious in Preclinical Models of Renal Cell Carcinoma. Cancer Res. 2016 Sep 15;76(18):5491-500.

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SDS
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