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Home > Imidazoles > 89454-35-3
89454-35-3 | Methanesulfonamide, N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-
CAS No: 89454-35-3 Catalog No: AG00433N MDL No:
Product Description
Catalog Number:
AG00433N
Chemical Name:
Methanesulfonamide, N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-
CAS Number:
89454-35-3
Molecular Formula:
C13H12N4O2S
Molecular Weight:
288.3250
IUPAC Name:
N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methanesulfonamide
InChI:
InChI=1S/C13H12N4O2S/c1-20(18,19)17-10-5-2-4-9(8-10)12-15-11-6-3-7-14-13(11)16-12/h2-8,17H,1H3,(H,14,15,16)
InChI Key:
LLLSMXKCXRHUNS-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)Nc1cccc(c1)c1nc2c([nH]1)cccn2
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.068g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.325g/mol
Monoisotopic Mass:
288.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
96.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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