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50693-74-8,MFCD01328381
Catalog No.:AA006WCL

50693-74-8 | 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
1 week  
$608.00   $425.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA006WCL
Chemical Name:
1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE
CAS Number:
50693-74-8
Molecular Formula:
C12H18N6O2
Molecular Weight:
278.3103
MDL Number:
MFCD01328381
SMILES:
Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCNCC1
Properties
Computed Properties
 
Complexity:
424  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-0.6  

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:50693-74-8 Molecular Formula|50693-74-8 MDL|50693-74-8 SMILES|50693-74-8 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE
Catalog No.: AA006WCL
50693-74-8,MFCD01328381
50693-74-8 | 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE
Pack Size： 1g
Purity：
1 week
$608.00 $425.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA006WCL
Chemical Name: 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE
CAS Number: 50693-74-8
Molecular Formula: C12H18N6O2
Molecular Weight: 278.3103
MDL Number: MFCD01328381
SMILES: Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCNCC1
Properties
Complexity: 424  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 20  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -0.6  
Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

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