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1260681-83-1 | 1H-Pyrazolo[3,4-b]pyridin-5-amine, 3-iodo-
CAS No: 1260681-83-1 Catalog No: AG000R28 MDL No:
Product Description
Catalog Number:
AG000R28
Chemical Name:
1H-Pyrazolo[3,4-b]pyridin-5-amine, 3-iodo-
CAS Number:
1260681-83-1
Molecular Formula:
C6H5IN4
Molecular Weight:
260.0352
IUPAC Name:
3-iodo-2H-pyrazolo[3,4-b]pyridin-5-amine
InChI:
InChI=1S/C6H5IN4/c7-5-4-1-3(8)2-9-6(4)11-10-5/h1-2H,8H2,(H,9,10,11)
InChI Key:
BHOKNYCMLGEQQN-UHFFFAOYSA-N
SMILES:
Nc1cnc2c(c1)c(I)n[nH]2
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.956g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.038g/mol
Monoisotopic Mass:
259.956g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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