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20208-81-5

20208-81-5 | 1H-Pyrazolo[3,4-b]pyridine, 1-phenyl-

CAS No: 20208-81-5 Catalog No: AG002823 MDL No:

Product Description

Catalog Number:
AG002823
Chemical Name:
1H-Pyrazolo[3,4-b]pyridine, 1-phenyl-
CAS Number:
20208-81-5
Molecular Formula:
C12H9N3
Molecular Weight:
195.2200
IUPAC Name:
1-phenylpyrazolo[3,4-b]pyridine
InChI:
InChI=1S/C12H9N3/c1-2-6-11(7-3-1)15-12-10(9-14-15)5-4-8-13-12/h1-9H
InChI Key:
UJDGVHVIOMSXMR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)n1ncc2c1nccc2
NSC Number:
127458

Properties

Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.08g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.225g/mol
Monoisotopic Mass:
195.08g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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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