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Home Other Building Blocks 794568-90-4
794568-90-4,MFCD31619335
Catalog No.:AA01EOCD

794568-90-4 | BAY 73-6691 racemate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
99%
1 week  
$138.00   $97.00
- +
10mg
99%
1 week  
$193.00   $135.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA01EOCD
Chemical Name:
BAY 73-6691 racemate
CAS Number:
794568-90-4
Molecular Formula:
C15H12ClF3N4O
Molecular Weight:
356.7302
MDL Number:
MFCD31619335
SMILES:
CC(C(F)(F)F)Cc1nc(=O)c2c([nH]1)n(nc2)c1ccccc1Cl
Properties
Computed Properties
 
Complexity:
527  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3.5  

Literature

Title: Liza Leventhal, et al. Phosphodiesterase 9 inhibitor and levodopa therapy. WO 2017070293 A1.

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SDS
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Tags:794568-90-4 Molecular Formula|794568-90-4 MDL|794568-90-4 SMILES|794568-90-4 BAY 73-6691 racemate