Home Fluorides 1160247-92-6
1160247-92-6,MFCD16618396
Catalog No.:AA000BCB

1160247-92-6 | 1H-Indole-2,3-dione, 1-[(4-methoxyphenyl)methyl]-5-(trifluoromethoxy)-

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5mg
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10mg
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25mg
≥98%
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50mg
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100mg
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000BCB
Chemical Name:
1H-Indole-2,3-dione, 1-[(4-methoxyphenyl)methyl]-5-(trifluoromethoxy)-
CAS Number:
1160247-92-6
Molecular Formula:
C17H12F3NO4
Molecular Weight:
351.2767
MDL Number:
MFCD16618396
SMILES:
COc1ccc(cc1)CN1c2ccc(cc2C(=O)C1=O)OC(F)(F)F
Properties
Computed Properties
 
Complexity:
517  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
7  
Rotatable Bond Count:
4  
XLogP3:
3.5  

Downstream Synthesis Route

[1]Bridges,ThomasM.;Marlo,JoyE.;Niswender,ColleenM.;Jones,CarrieK.;Jadhav,SatyawanB.;Gentry,PatrickR.;Plumley,HyekyungC.;Weaver,C.David;Conn,P.Jeffrey;Lindsley,CraigW.[JournalofMedicinalChemistry,2009,vol.52,#11,p.3445-3448]

[2]Li,Zheng-Fei;Lu,Chong-Dao;Yao,Yun;Zhang,Yun;Zhu,Chong-Lin[OrganicLetters,2022,vol.24,#15,p.2883-2888]

[1]Gentry,PatrickR.;Bridges,ThomasM.;Lamsal,Atin;Vinson,PaigeN.;Smith,Emery;Chase,Peter;Hodder,PeterS.;Engers,JulieL.;Niswender,ColleenM.;ScottDaniels;JeffreyConn;Wood,MichaelR.;Lindsley,CraigW.[BioorganicandMedicinalChemistryLetters,2013,vol.23,#10,p.2996-3000]

[1]Gentry,PatrickR.;Bridges,ThomasM.;Lamsal,Atin;Vinson,PaigeN.;Smith,Emery;Chase,Peter;Hodder,PeterS.;Engers,JulieL.;Niswender,ColleenM.;ScottDaniels;JeffreyConn;Wood,MichaelR.;Lindsley,CraigW.[BioorganicandMedicinalChemistryLetters,2013,vol.23,#10,p.2996-3000]

[1]Gentry,PatrickR.;Bridges,ThomasM.;Lamsal,Atin;Vinson,PaigeN.;Smith,Emery;Chase,Peter;Hodder,PeterS.;Engers,JulieL.;Niswender,ColleenM.;ScottDaniels;JeffreyConn;Wood,MichaelR.;Lindsley,CraigW.[BioorganicandMedicinalChemistryLetters,2013,vol.23,#10,p.2996-3000]

1160247-92-6   
3-(hydroxyimino)-1-(4-methoxybenzyl)-5-(trifluoromethoxy)indolin-2-one 

[1]Cieślik,Paulina;Woźniak,Monika;Tokarski,Krzysztof;Kusek,Magdalena;Pilc,Andrzej;Płoska,Agata;Radulska,Adrianna;Pelikant-Małecka,Iwona;Żołnowska,Beata;Sławiński,Jarosław;Kalinowski,Leszek;Wierońska,JoannaM[BehaviouralBrainResearch,2019,vol.359,p.671-685]

Literature

Title: Discovery of the first highly M5-preferring muscarinic acetylcholine receptor ligand, an M5 positive allosteric modulator derived from a series of 5-trifluoromethoxy N-benzyl isatins.

Journal: Journal of medicinal chemistry 20090611

Title: Bridges TM, et al. Discovery of the first highly M5-preferring muscarinic acetylcholine receptor ligand, an M5 positive allosteric modulator derived from a series of 5-trifluoromethoxy N-benzyl isatins.

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SDS
Tags:1160247-92-6 Molecular Formula|1160247-92-6 MDL|1160247-92-6 SMILES|1160247-92-6 1H-Indole-2,3-dione, 1-[(4-methoxyphenyl)methyl]-5-(trifluoromethoxy)-