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573939-28-3

573939-28-3 | 3H-Pyrazolo[3,4-b]pyridin-3-one,1,2-dihydro-4,6-dimethyl-1-(1-methylbutyl)-(9CI)

CAS No: 573939-28-3 Catalog No: AG00EXQE MDL No:

Product Description

Catalog Number:
AG00EXQE
Chemical Name:
3H-Pyrazolo[3,4-b]pyridin-3-one,1,2-dihydro-4,6-dimethyl-1-(1-methylbutyl)-(9CI)
CAS Number:
573939-28-3
IUPAC Name:
4,6-dimethyl-1-pentan-2-yl-2H-pyrazolo[3,4-b]pyridin-3-one
InChI:
InChI=1S/C13H19N3O/c1-5-6-10(4)16-12-11(13(17)15-16)8(2)7-9(3)14-12/h7,10H,5-6H2,1-4H3,(H,15,17)
InChI Key:
IQDLJPXMBFQARP-UHFFFAOYSA-N

Properties

Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.153g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.315g/mol
Monoisotopic Mass:
233.153g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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