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101617-91-8,MFCD02740422
Catalog No.:AA0004WL

101617-91-8 | 2-Chloro-6-methoxyquinoline-3-carbonitrile

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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:
AA0004WL
Chemical Name:
2-Chloro-6-methoxyquinoline-3-carbonitrile
CAS Number:
101617-91-8
Molecular Formula:
C11H7ClN2O
Molecular Weight:
218.6391
MDL Number:
MFCD02740422
SMILES:
COc1ccc2c(c1)cc(c(n2)Cl)C#N
Properties
Computed Properties
 
Complexity:
275  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
1  
XLogP3:
2.8  

Downstream Synthesis Route

[1]Zhao,Yan;Li,Min;Li,Bowen;Zhang,Shun;Su,Aoze;Xing,Yongning;Ge,Zemei;Li,Runtao;Yang,Baoxue[EuropeanJournalofMedicinalChemistry,2019,vol.172,p.131-142]

[2]Locationinpatent:experimentalpartUpadhyay,Shraddha;Chandra,Atish;Singh,RadheyM.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2009,vol.48,#1,p.152-154]

[3]Srivastava,Ambika;Singh[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2005,vol.44,#9,p.1868-1875]

[4]Baxendale,IanR.;Ley,StevenV.;Sneddon,HelenF.[Synlett,2002,#5,p.775-777]

[5]Locationinpatent:schemeortableUpadhyay,Shraddha;Chandra,Atish;Singh,Seema;Singh,RadheyM.[JournalofHeterocyclicChemistry,2011,vol.48,#5,p.1202-1205]

[6]Locationinpatent:schemeortableChandra,Atish;Upadhyay,Shraddha;Singh,Bhawana;Sharma,Neha;Singh,RadheyM.[Tetrahedron,2011,vol.67,#47,p.9219-9224]

[7]Karthikeyan,Chandrabose;Amawi,Haneen;Viana,ArabelaGuedes;Sanglard,Leticia;Hussein,Noor;Saddler,Maria;Ashby,CharlesR.;Moorthy,N.S.HariNarayana;Trivedi,Piyush;Tiwari,AmitK.[BioorganicandMedicinalChemistryLetters,2018,vol.28,#13,p.2244-2249]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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