Name: Name:5-Bromo-7-methoxy-1-methyl-1H-benzo[d][1,2,3]triazole
Brand: AABLOCKS
SKU: AA0021HB
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA0021HB

Chemical Name: 5-Bromo-7-methoxy-1-methyl-1H-benzo[d][1,2,3]triazole

CAS Number: 1799973-82-2

Molecular Formula: C8H8BrN3O

Molecular Weight: 242.0726

MDL Number: MFCD28969711

SMILES: COc1cc(Br)cc2c1n(C)nn2

Properties

Complexity: 192

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 13

Hydrogen Bond Acceptor Count: 3

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.8

Downstream Synthesis Route

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[1]Tran,KimT.;Pallesen,JakobS.;Solbak,SaraM.;Narayanan,Dilip;Baig,Amina;Zang,Jie;Aguayo-Orozco,Alejandro;Carmona,RosaM.C.;Garcia,AnthonyD.;Bach,Anders[JournalofMedicinalChemistry,2019,vol.62,#17,p.8028-8052]

[2]Davies,ThomasG.;Wixted,WilliamE.;Coyle,JosephE.;Griffiths-Jones,Charlotte;Hearn,Keisha;McMenamin,Rachel;Norton,David;Rich,SharnaJ.;Richardson,Caroline;Saxty,Gordon;Willems,HenriëtteM.G.;Woolford,AlisonJ.-A.;Cottom,JoshuaE.;Kou,Jen-Pyng;Yonchuk,JohnG.;Feldser,HeidiG.;Sanchez,Yolanda;Foley,JosephP.;Bolognese,BrianJ.;Logan,Gregory;Podolin,PatriciaL.;Yan,Hongxing;Callahan,JamesF.;Heightman,TomD.;Kerns,JeffreyK.[JournalofMedicinalChemistry,2016,vol.59,#8,p.3991-4006]

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC;OTSUKAHOLDINGSCOLTD-WO2015/92713,2015,A1Locationinpatent:Page/Pagecolumn70

[4]CurrentPatentAssignee:GLAXOSMITHKLINEPLC;OTSUKAHOLDINGSCOLTD-WO2016/203400,2016,A1Locationinpatent:Page/Pagecolumn47

[5]CurrentPatentAssignee:DANA-FARBERCANCERINSTITUTE-WO2020/210229,2020,A1Locationinpatent:Paragraph00133

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[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC;OTSUKAHOLDINGSCOLTD-WO2015/92713,2015,A1

[2]Davies,ThomasG.;Wixted,WilliamE.;Coyle,JosephE.;Griffiths-Jones,Charlotte;Hearn,Keisha;McMenamin,Rachel;Norton,David;Rich,SharnaJ.;Richardson,Caroline;Saxty,Gordon;Willems,HenriëtteM.G.;Woolford,AlisonJ.-A.;Cottom,JoshuaE.;Kou,Jen-Pyng;Yonchuk,JohnG.;Feldser,HeidiG.;Sanchez,Yolanda;Foley,JosephP.;Bolognese,BrianJ.;Logan,Gregory;Podolin,PatriciaL.;Yan,Hongxing;Callahan,JamesF.;Heightman,TomD.;Kerns,JeffreyK.[JournalofMedicinalChemistry,2016,vol.59,#8,p.3991-4006]

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC;OTSUKAHOLDINGSCOLTD-WO2016/202253,2016,A1

[4]CurrentPatentAssignee:DANA-FARBERCANCERINSTITUTE-WO2020/210229,2020,A1

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[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC;OTSUKAHOLDINGSCOLTD-WO2015/92713,2015,A1

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[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC;OTSUKAHOLDINGSCOLTD-WO2015/92713,2015,A1

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[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC;OTSUKAHOLDINGSCOLTD-WO2015/92713,2015,A1

1799973-82-2 | 5-Bromo-7-methoxy-1-methyl-1H-benzo[d][1,2,3]triazole