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878419-78-4,MFCD07188899
Catalog No.:AA00GU4L

878419-78-4 | Walrycin B

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$36.00   $25.00
- +
5mg
98%
in stock  
$85.00   $59.00
- +
10mg
98%
in stock  
$136.00   $96.00
- +
25mg
98%
in stock  
$180.00   $126.00
- +
50mg
98%
in stock  
$300.00   $210.00
- +
100mg
95%
in stock  
$490.00   $343.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00GU4L
Chemical Name:
Walrycin B
CAS Number:
878419-78-4
Molecular Formula:
C14H10F3N5O2
Molecular Weight:
337.2567
MDL Number:
MFCD07188899
SMILES:
Cn1nc(nc2c1nc(=O)n(c2=O)C)c1ccc(cc1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
674  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Downstream Synthesis Route

[1]Raoof,Ali;Depledge,Paul;Hamilton,NiallM.;Hamilton,NicolaS.;Hitchin,JamesR.;Hopkins,GemmaV.;Jordan,AllanM.;Maguire,LauraA.;McGonagle,AlisonE.;Mould,DanielP.;Rushbrooke,Mathew;Small,HelenF.;Smith,KateM.;Thomson,GraemeJ.;Turlais,Fabrice;Waddell,IanD.;Waszkowycz,Bohdan;Watson,AmandaJ.;Ogilvie,DonaldJ.[JournalofMedicinalChemistry,2013,vol.56,#16,p.6352-6370]

[1]Raoof,Ali;Depledge,Paul;Hamilton,NiallM.;Hamilton,NicolaS.;Hitchin,JamesR.;Hopkins,GemmaV.;Jordan,AllanM.;Maguire,LauraA.;McGonagle,AlisonE.;Mould,DanielP.;Rushbrooke,Mathew;Small,HelenF.;Smith,KateM.;Thomson,GraemeJ.;Turlais,Fabrice;Waddell,IanD.;Waszkowycz,Bohdan;Watson,AmandaJ.;Ogilvie,DonaldJ.[JournalofMedicinalChemistry,2013,vol.56,#16,p.6352-6370]

[1]Raoof,Ali;Depledge,Paul;Hamilton,NiallM.;Hamilton,NicolaS.;Hitchin,JamesR.;Hopkins,GemmaV.;Jordan,AllanM.;Maguire,LauraA.;McGonagle,AlisonE.;Mould,DanielP.;Rushbrooke,Mathew;Small,HelenF.;Smith,KateM.;Thomson,GraemeJ.;Turlais,Fabrice;Waddell,IanD.;Waszkowycz,Bohdan;Watson,AmandaJ.;Ogilvie,DonaldJ.[JournalofMedicinalChemistry,2013,vol.56,#16,p.6352-6370]

Literature

Title: Pyrimido[5,4-e][1,2,4]triazine-5,7(1H,6H)-dione derivatives: their cytoprotection effect from rotenone toxicity and preliminary DMPK properties.

Journal: Bioorganic & medicinal chemistry letters 20091101

Title: Gotoh Y, et al. Novel antibacterial compounds specifically targeting the essential WalR response regulator. J Antibiot (Tokyo). 2010 Mar;63(3):127-34.

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SDS
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