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Home Quinolines 54761-87-4
54761-87-4,MFCD00552738
Catalog No.:AA0035RS

54761-87-4 | 2-Benzoyl-1,2,3,6,7,11b-hexahydro-pyrazino[2,1-a]isoquinolin-4-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
99%(HPLC)
in stock  
$80.00   $56.00
- +
1g
99%(HPLC)
in stock  
$191.00   $134.00
- +
5g
99%(HPLC)
in stock  
$572.00   $400.00
- +
10g
99%(HPLC)
in stock  
$953.00   $667.00
- +
25g
99%(HPLC)
in stock  
$1,905.00   $1,334.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0035RS
Chemical Name:
2-Benzoyl-1,2,3,6,7,11b-hexahydro-pyrazino[2,1-a]isoquinolin-4-one
CAS Number:
54761-87-4
Molecular Formula:
C19H18N2O2
Molecular Weight:
306.3584
MDL Number:
MFCD00552738
SMILES:
O=C(N1CC(=O)N2C(C1)c1ccccc1CC2)c1ccccc1
Properties
Properties
 
BP:
539.904°C at 760 mmHg  
Form:
Solid  
MP:
158-161°C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
472  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
2.2  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:54761-87-4 Molecular Formula|54761-87-4 MDL|54761-87-4 SMILES|54761-87-4 2-Benzoyl-1,2,3,6,7,11b-hexahydro-pyrazino[2,1-a]isoquinolin-4-one