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347887-36-9,MFCD19443737
Catalog No.:AA01E45P

347887-36-9 | Fedovapagon

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
99%
in stock  
$333.00   $233.00
- +
25mg
99%
in stock  
$1,079.00   $755.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01E45P
Chemical Name:
Fedovapagon
CAS Number:
347887-36-9
Molecular Formula:
C27H34N4O3
Molecular Weight:
462.5839
MDL Number:
MFCD19443737
SMILES:
CN(C(=O)[C@@H]1CCCN1C(=O)NCc1ccc(cc1C)C(=O)N1CCCCc2c1cccc2)C
Properties
Computed Properties
 
Complexity:
741  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.2  

Downstream Synthesis Route
C23H24N4O2 
  29802-22-0    347887-36-9 

[1]Locationinpatent:experimentalpartYea,ChristopherM.;Allan,ChristineE.;Ashworth,DoreenM.;Barnett,James;Baxter,AndyJ.;Broadbridge,JaniceD.;Franklin,RichardJ.;Hampton,SallyL.;Hudson,Peter;Horton,JohnA.;Jenkins,PaulD.;Penson,AndyM.;Pitt,GaryR.W.;Rivière,Pierre;Robson,PeterA.;Rooker,DavidP.;Semple,Graeme;Sheppard,Andy;Haigh,RobertM.;Roe,MichaelB.[JournalofMedicinalChemistry,2008,vol.51,#24,p.8124-8134]

347887-36-9    69-72-7   
(x)C7H6O3*C27H34N4O3 

[1]CurrentPatentAssignee:TEVAPHARMACEUTICALINDUSTRIESLTD.-WO2020/154581,2020,A1Locationinpatent:Paragraph00106-00108;00113-00114

347887-36-9    69-72-7   
C27H34N4O3*C7H6O3 

[1]CurrentPatentAssignee:TEVAPHARMACEUTICALINDUSTRIESLTD.-WO2020/154581,2020,A1Locationinpatent:Paragraph00109-00112

Literature

Title: New benzylureas as a novel series of potent, nonpeptidic vasopressin V2 receptor agonists.

Journal: Journal of medicinal chemistry 20081225

Title: Yea CM, et al. New benzylureas as a novel series of potent, nonpeptidic vasopressin V2 receptor agonists. J Med Chem. 2008 Dec 25;51(24):8124-34.

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SDS
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Historical Records
37081-76-8

37081-76-8
Tags:347887-36-9 Molecular Formula|347887-36-9 MDL|347887-36-9 SMILES|347887-36-9 Fedovapagon
Catalog No.: AA01E45P
347887-36-9,MFCD19443737
347887-36-9 | Fedovapagon
Pack Size： 5mg
Purity： 99%
in stock
$333.00 $233.00
Pack Size： 25mg
Purity： 99%
in stock
$1,079.00 $755.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01E45P
Chemical Name: Fedovapagon
CAS Number: 347887-36-9
Molecular Formula: C27H34N4O3
Molecular Weight: 462.5839
MDL Number: MFCD19443737
SMILES: CN(C(=O)[C@@H]1CCCN1C(=O)NCc1ccc(cc1C)C(=O)N1CCCCc2c1cccc2)C
Properties
Complexity: 741  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 1  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 34  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.2  
Downstream Synthesis Route
C23H24N4O2 
  29802-22-0    347887-36-9 

[1]Locationinpatent:experimentalpartYea,ChristopherM.;Allan,ChristineE.;Ashworth,DoreenM.;Barnett,James;Baxter,AndyJ.;Broadbridge,JaniceD.;Franklin,RichardJ.;Hampton,SallyL.;Hudson,Peter;Horton,JohnA.;Jenkins,PaulD.;Penson,AndyM.;Pitt,GaryR.W.;Rivière,Pierre;Robson,PeterA.;Rooker,DavidP.;Semple,Graeme;Sheppard,Andy;Haigh,RobertM.;Roe,MichaelB.[JournalofMedicinalChemistry,2008,vol.51,#24,p.8124-8134]

347887-36-9    69-72-7   
(x)C7H6O3*C27H34N4O3 

[1]CurrentPatentAssignee:TEVAPHARMACEUTICALINDUSTRIESLTD.-WO2020/154581,2020,A1Locationinpatent:Paragraph00106-00108;00113-00114

347887-36-9    69-72-7   
C27H34N4O3*C7H6O3 

[1]CurrentPatentAssignee:TEVAPHARMACEUTICALINDUSTRIESLTD.-WO2020/154581,2020,A1Locationinpatent:Paragraph00109-00112

Literature fold

Title: New benzylureas as a novel series of potent, nonpeptidic vasopressin V2 receptor agonists.

Journal: Journal of medicinal chemistry20081225

Title: Yea CM, et al. New benzylureas as a novel series of potent, nonpeptidic vasopressin V2 receptor agonists. J Med Chem. 2008 Dec 25;51(24):8124-34.

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