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88122-99-0,MFCD09753106
Catalog No.:AA003AL2

88122-99-0 | Octyl triazone

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
>98.0%(N)
in stock  
$20.00   $14.00
- +
5g
98%(HPLC)
in stock  
$24.00   $17.00
- +
25g
97%
in stock  
$43.00   $30.00
- +
100g
97%
in stock  
$123.00 $86.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003AL2
Chemical Name:
Octyl triazone
CAS Number:
88122-99-0
Molecular Formula:
C48H66N6O6
Molecular Weight:
823.0742
MDL Number:
MFCD09753106
SMILES:
CCCCC(COC(=O)c1ccc(cc1)Nc1nc(Nc2ccc(cc2)C(=O)OCC(CCCC)CC)nc(n1)Nc1ccc(cc1)C(=O)OCC(CCCC)CC)CC
Properties
Computed Properties
 
Complexity:
1030  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
60  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
30  
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0  
XLogP3:
14.5  

Literature

Title: Pinto-Bazurco Mendieta MA, et al. Highly potent and selective nonsteroidal dual inhibitors of CYP17/CYP11B2 for the treatment ofprostate cancer to reduce risks of cardiovascular diseases. J Med Chem. 2013 Aug 8;56(15):6101-7.

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SDS
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Tags:88122-99-0 Molecular Formula|88122-99-0 MDL|88122-99-0 SMILES|88122-99-0 Octyl triazone
Catalog No.: AA003AL2
88122-99-0,MFCD09753106
88122-99-0 | Octyl triazone
Pack Size： 1g
Purity： >98.0%(N)
in stock
$20.00 $14.00
Pack Size： 5g
Purity： 98%(HPLC)
in stock
$24.00 $17.00
Pack Size： 25g
Purity： 97%
in stock
$43.00 $30.00
Pack Size： 100g
Purity： 97%
in stock
$123.00 $86.00
Quantity
- +
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Technical Information
Catalog Number: AA003AL2
Chemical Name: Octyl triazone
CAS Number: 88122-99-0
Molecular Formula: C48H66N6O6
Molecular Weight: 823.0742
MDL Number: MFCD09753106
SMILES: CCCCC(COC(=O)c1ccc(cc1)Nc1nc(Nc2ccc(cc2)C(=O)OCC(CCCC)CC)nc(n1)Nc1ccc(cc1)C(=O)OCC(CCCC)CC)CC
Properties
Complexity: 1030  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 60  
Hydrogen Bond Acceptor Count: 12  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 30  
Undefined Atom Stereocenter Count: 3  
Undefined Bond Stereocenter Count: 0  
XLogP3: 14.5  
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