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1315329-43-1,MFCD28167804
Catalog No.:AA009C9I

1315329-43-1 | Hg6-64-1

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10mg
95%
in stock  
$525.00   $368.00
- +
25mg
95%
in stock  
$874.00   $612.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA009C9I
Chemical Name:
Hg6-64-1
CAS Number:
1315329-43-1
Molecular Formula:
C32H34F3N5O2
Molecular Weight:
577.6399
MDL Number:
MFCD28167804
SMILES:
CCN1CCN(CC1)Cc1ccc(cc1C(F)(F)F)NC(=O)c1ccc(c(c1)C=Cc1cnc2c(c1OC)cc[nH]2)C
Properties
Computed Properties
 
Complexity:
911  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
1  
Formal Charge:
0  
Heavy Atom Count:
42  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
8  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
5.7  

Downstream Synthesis Route

[1]Patent:WO2011/90738,2011,A2.Locationinpatent:Page/Pagecolumn71

[1]JournalofMedicinalChemistry,2015,vol.58,p.183-196

Literature

Title: WO 2011090738 A2

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SDS
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Tags:1315329-43-1 Molecular Formula|1315329-43-1 MDL|1315329-43-1 SMILES|1315329-43-1 Hg6-64-1
Catalog No.: AA009C9I
1315329-43-1,MFCD28167804
1315329-43-1 | Hg6-64-1
Pack Size： 10mg
Purity： 95%
in stock
$525.00 $368.00
Pack Size： 25mg
Purity： 95%
in stock
$874.00 $612.00
Quantity
- +
Add to Card
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Technical Information
Catalog Number: AA009C9I
Chemical Name: Hg6-64-1
CAS Number: 1315329-43-1
Molecular Formula: C32H34F3N5O2
Molecular Weight: 577.6399
MDL Number: MFCD28167804
SMILES: CCN1CCN(CC1)Cc1ccc(cc1C(F)(F)F)NC(=O)c1ccc(c(c1)C=Cc1cnc2c(c1OC)cc[nH]2)C
Properties
Complexity: 911  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 1  
Formal Charge: 0  
Heavy Atom Count: 42  
Hydrogen Bond Acceptor Count: 8  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 8  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 5.7  
Downstream Synthesis Route
630125-91-6    1315467-35-6    1315329-43-1 

[1]Patent:WO2011/90738,2011,A2.Locationinpatent:Page/Pagecolumn71

630125-91-6    1315329-43-1 

[1]JournalofMedicinalChemistry,2015,vol.58,p.183-196

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