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Home > Imidazoles > 63411-78-9
63411-78-9 | 2-(4-Pyridyl)-7-azabenzimidazole
CAS No: 63411-78-9 Catalog No: AG01EWQQ MDL No:MFCD01001152
Product Description
Catalog Number:
AG01EWQQ
Chemical Name:
2-(4-Pyridyl)-7-azabenzimidazole
CAS Number:
63411-78-9
Molecular Formula:
C11H8N4
Molecular Weight:
196.2080
MDL Number:
MFCD01001152
IUPAC Name:
2-pyridin-4-yl-1H-imidazo[4,5-b]pyridine
InChI:
InChI=1S/C11H8N4/c1-2-9-11(13-5-1)15-10(14-9)8-3-6-12-7-4-8/h1-7H,(H,13,14,15)
InChI Key:
RGMLYYSJGMFNCA-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)c1nc2c([nH]1)nccc2
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.075g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.213g/mol
Monoisotopic Mass:
196.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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