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1562995-68-9

1562995-68-9 | 1H-Pyrazolo[4,3-b]pyridine, 3-iodo-1-(tetrahydro-2H-pyran-2-yl)-

CAS No: 1562995-68-9 Catalog No: AG00ILWD MDL No:

Product Description

Catalog Number:
AG00ILWD
Chemical Name:
1H-Pyrazolo[4,3-b]pyridine, 3-iodo-1-(tetrahydro-2H-pyran-2-yl)-
CAS Number:
1562995-68-9
Molecular Formula:
C11H12IN3O
Molecular Weight:
329.1369
IUPAC Name:
3-iodo-1-(oxan-2-yl)pyrazolo[4,3-b]pyridine
InChI:
InChI=1S/C11H12IN3O/c12-11-10-8(4-3-6-13-10)15(14-11)9-5-1-2-7-16-9/h3-4,6,9H,1-2,5,7H2
InChI Key:
QHHOJYBMAQHTTB-UHFFFAOYSA-N
SMILES:
Ic1nn(c2c1nccc2)C1CCCCO1

Properties

Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.003g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.141g/mol
Monoisotopic Mass:
329.003g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
39.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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