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PF 04447943

CAS No.:
1082744-20-4
Catalog Number:
AG008TIW
Molecular Formula:
C20H25N7O2
Molecular Weight:
395.4582
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$96
- +
5mg
≥98%
1 week
United States
$164
- +
10mg
≥98%
1 week
United States
$251
- +
25mg
≥98%
1 week
United States
$494
- +
Product Description
Catalog Number:
AG008TIW
Chemical Name:
PF 04447943
CAS Number:
1082744-20-4
Molecular Formula:
C20H25N7O2
Molecular Weight:
395.4582
MDL Number:
MFCD22665724
IUPAC Name:
6-[(3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl]-1-(oxan-4-yl)-5H-pyrazolo[3,4-d]pyrimidin-4-one
InChI:
InChI=1S/C20H25N7O2/c1-13-10-26(12-17-21-5-2-6-22-17)11-16(13)18-24-19-15(20(28)25-18)9-23-27(19)14-3-7-29-8-4-14/h2,5-6,9,13-14,16H,3-4,7-8,10-12H2,1H3,(H,24,25,28)/t13-,16-/m1/s1
InChI Key:
IWXUVYOOUMLUTQ-CZUORRHYSA-N
SMILES:
C[C@@H]1CN(C[C@H]1c1nc(=O)c2c([nH]1)n(nc2)C1CCOCC1)Cc1ncccn1
UNII:
7N969W8Y4O
Properties
Complexity:
632  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
395.207g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
395.467g/mol
Monoisotopic Mass:
395.207g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
97.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties