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2654-13-9 | 3H-IMidazo[4,5-c]pyridine, 2-(phenylMethyl)-
CAS No: 2654-13-9 Catalog No: AG002TMR MDL No:
Product Description
Catalog Number:
AG002TMR
Chemical Name:
3H-IMidazo[4,5-c]pyridine, 2-(phenylMethyl)-
CAS Number:
2654-13-9
Molecular Formula:
C13H11N3
Molecular Weight:
209.2465
IUPAC Name:
2-benzyl-3H-imidazo[4,5-c]pyridine
InChI:
InChI=1S/C13H11N3/c1-2-4-10(5-3-1)8-13-15-11-6-7-14-9-12(11)16-13/h1-7,9H,8H2,(H,15,16)
InChI Key:
HRQRBCRHCRDWMJ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cc1nc2c([nH]1)cncc2
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.252g/mol
Monoisotopic Mass:
209.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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