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1029720-67-9,MFCD11044700
Catalog No.:AA007Y92

1029720-67-9 | 5-Bromo-3-chloroisoquinoline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$22.00   $16.00
- +
250mg
95%
in stock  
$26.00   $19.00
- +
5g
95%
in stock  
$502.00   $351.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA007Y92
Chemical Name:
5-Bromo-3-chloroisoquinoline
CAS Number:
1029720-67-9
Molecular Formula:
C9H5BrClN
Molecular Weight:
242.4997
MDL Number:
MFCD11044700
SMILES:
Clc1ncc2c(c1)c(Br)ccc2
Properties
Computed Properties
 
Complexity:
165  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.8  

Downstream Synthesis Route

[1]CurrentPatentAssignee:GruenenthalPharmaGmbH&Co.Kommanditgesellschaft-WO2010/127855,2010,A1Locationinpatent:Page/Pagecolumn136;138

[1]Patent:WO2010/127855,2010,A1.Locationinpatent:Page/Pagecolumn136;137;138

[1]Patent:WO2014/37750,2014,A1.Locationinpatent:Paragraph0010;0011

[1]Innocenti,Paolo;Woodward,HannahL.;Solanki,Savade;Naud,Sébastien;Westwood,IsaacM.;Cronin,Nora;Hayes,Angela;Roberts,Jennie;Henley,AlanT.;Baker,Ross;Faisal,Amir;Mak,GraceWing-Yan;Box,Gary;Valenti,Melanie;DeHavenBrandon,Alexis;O'Fee,Lisa;Saville,Harry;Schmitt,Jessica;Matijssen,Berry;Burke,Rosemary;VanMontfort,RobL.M.;Raynaud,FlorenceI.;Eccles,SuzanneA.;Linardopoulos,Spiros;Blagg,Julian;Hoelder,Swen[JournalofMedicinalChemistry,2016,vol.59,#8,p.3671-3688]

[2]CurrentPatentAssignee:CANCERRESEARCHUK-WO2014/37750,2014,A1Locationinpatent:Paragraph0010;0011

[1]CurrentPatentAssignee:CANCERRESEARCHUK-WO2014/37750,2014,A1

Literature
Quotation Request
Company Name:
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Contact Person:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:1029720-67-9 Molecular Formula|1029720-67-9 MDL|1029720-67-9 SMILES|1029720-67-9 5-Bromo-3-chloroisoquinoline
Catalog No.: AA007Y92
1029720-67-9,MFCD11044700
1029720-67-9 | 5-Bromo-3-chloroisoquinoline
Pack Size： 100mg
Purity： 95%
in stock
$22.00 $16.00
Pack Size： 250mg
Purity： 95%
in stock
$26.00 $19.00
Pack Size： 5g
Purity： 95%
in stock
$502.00 $351.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA007Y92
Chemical Name: 5-Bromo-3-chloroisoquinoline
CAS Number: 1029720-67-9
Molecular Formula: C9H5BrClN
Molecular Weight: 242.4997
MDL Number: MFCD11044700
SMILES: Clc1ncc2c(c1)c(Br)ccc2
Properties
Complexity: 165  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.8  
Downstream Synthesis Route
1029720-67-9    535-13-7    1254715-58-6 

[1]CurrentPatentAssignee:GruenenthalPharmaGmbH&Co.Kommanditgesellschaft-WO2010/127855,2010,A1Locationinpatent:Page/Pagecolumn136;138

58142-49-7    1029720-67-9 

[1]Patent:WO2010/127855,2010,A1.Locationinpatent:Page/Pagecolumn136;137;138

879487-10-2    1029720-67-9    1578245-82-5 

[1]Patent:WO2014/37750,2014,A1.Locationinpatent:Paragraph0010;0011

1029720-67-9    761446-44-0    1578245-81-4 

[1]Innocenti,Paolo;Woodward,HannahL.;Solanki,Savade;Naud,Sébastien;Westwood,IsaacM.;Cronin,Nora;Hayes,Angela;Roberts,Jennie;Henley,AlanT.;Baker,Ross;Faisal,Amir;Mak,GraceWing-Yan;Box,Gary;Valenti,Melanie;DeHavenBrandon,Alexis;O'Fee,Lisa;Saville,Harry;Schmitt,Jessica;Matijssen,Berry;Burke,Rosemary;VanMontfort,RobL.M.;Raynaud,FlorenceI.;Eccles,SuzanneA.;Linardopoulos,Spiros;Blagg,Julian;Hoelder,Swen[JournalofMedicinalChemistry,2016,vol.59,#8,p.3671-3688]

[2]CurrentPatentAssignee:CANCERRESEARCHUK-WO2014/37750,2014,A1Locationinpatent:Paragraph0010;0011

1029720-67-9    1578243-56-7 

[1]CurrentPatentAssignee:CANCERRESEARCHUK-WO2014/37750,2014,A1

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