518-67-2,MFCD00149984
Catalog No.:AA003PKW

518-67-2 | Dimidium bromide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$36.00   $25.00
- +
5g
95%
in stock  
$100.00   $70.00
- +
25g
95%
in stock  
$372.00   $260.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003PKW
Chemical Name:
Dimidium bromide
CAS Number:
518-67-2
Molecular Formula:
C20H18BrN3
Molecular Weight:
380.2810
MDL Number:
MFCD00149984
SMILES:
Nc1ccc2c(c1)c(c1ccccc1)[n+](c1c2ccc(c1)N)C.[Br-]
NSC Number:
522842
Properties
Properties
 
Form:
Solid  
MP:
243-248 °C(lit.)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
406  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route

[1]Barberetal.[JournaloftheSocietyofChemicalIndustry,1950,vol.69,p.82,92]

2-amino-4-chloro-1,6-dimethyl-pyrimidinium;iodide 
  518-67-2   
3-amino-8-(2-amino-1,6-dimethyl-pyrimidinium-4-ylamino)-5-methyl-6-phenyl-phenanthridinium;diiodide 

[1]Watkins[JournaloftheChemicalSociety,1958,p.1443,1445]

2-amino-4-chloro-1,6-dimethyl-pyrimidinium;iodide 
  518-67-2   
3,8-bis-(2-amino-1,6-dimethyl-pyrimidinium-4-ylamino)-6-(4-chloro-phenyl)-5-methyl-phenanthridinium;trisiodide 

[1]Watkins[JournaloftheChemicalSociety,1958,p.1443,1445]

Literature

Title: A comprehensive strategy to discover inhibitors of the translesion synthesis DNA polymerase κ.

Journal: PloS one 20120101

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
Related Products of 518-67-2
Tags:518-67-2 Molecular Formula|518-67-2 MDL|518-67-2 SMILES|518-67-2 Dimidium bromide
Catalog No.: AA003PKW
518-67-2,MFCD00149984
518-67-2 | Dimidium bromide
Pack Size: 1g
Purity: 95%
in stock
$36.00 $25.00
Pack Size: 5g
Purity: 95%
in stock
$100.00 $70.00
Pack Size: 25g
Purity: 95%
in stock
$372.00 $260.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA003PKW
Chemical Name: Dimidium bromide
CAS Number: 518-67-2
Molecular Formula: C20H18BrN3
Molecular Weight: 380.2810
MDL Number: MFCD00149984
SMILES: Nc1ccc2c(c1)c(c1ccccc1)[n+](c1c2ccc(c1)N)C.[Br-]
NSC Number: 522842
Properties
Form: Solid  
MP: 243-248 °C(lit.)  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 406  
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 24  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
875227-05-7    518-67-2 

[1]Barberetal.[JournaloftheSocietyofChemicalIndustry,1950,vol.69,p.82,92]

2-amino-4-chloro-1,6-dimethyl-pyrimidinium;iodide 
  518-67-2   
3-amino-8-(2-amino-1,6-dimethyl-pyrimidinium-4-ylamino)-5-methyl-6-phenyl-phenanthridinium;diiodide 

[1]Watkins[JournaloftheChemicalSociety,1958,p.1443,1445]

2-amino-4-chloro-1,6-dimethyl-pyrimidinium;iodide 
  518-67-2   
3,8-bis-(2-amino-1,6-dimethyl-pyrimidinium-4-ylamino)-6-(4-chloro-phenyl)-5-methyl-phenanthridinium;trisiodide 

[1]Watkins[JournaloftheChemicalSociety,1958,p.1443,1445]

Literature fold

Title: A comprehensive strategy to discover inhibitors of the translesion synthesis DNA polymerase κ.

Journal: PloS one20120101

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 Cytology20060501

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