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96793-52-1 | 1-benzyl-3-methyl-1H-pyrazolo[3,4-b]pyridine
CAS No: 96793-52-1 Catalog No: AG00N7A6 MDL No:MFCD00441056
Product Description
Catalog Number:
AG00N7A6
Chemical Name:
1-benzyl-3-methyl-1H-pyrazolo[3,4-b]pyridine
CAS Number:
96793-52-1
Molecular Formula:
C14H13N3
Molecular Weight:
223.2731
MDL Number:
MFCD00441056
IUPAC Name:
1-benzyl-3-methylpyrazolo[3,4-b]pyridine
InChI:
InChI=1S/C14H13N3/c1-11-13-8-5-9-15-14(13)17(16-11)10-12-6-3-2-4-7-12/h2-9H,10H2,1H3
InChI Key:
GLYFDIZBHQMLAU-UHFFFAOYSA-N
SMILES:
Cc1nn(c2c1cccn2)Cc1ccccc1
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.111g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.279g/mol
Monoisotopic Mass:
223.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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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