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89469-37-4 | Phenol, 3-(1H-imidazo[4,5-b]pyridin-2-yl)-2-methoxy-
CAS No: 89469-37-4 Catalog No: AG0042A7 MDL No:
Product Description
Catalog Number:
AG0042A7
Chemical Name:
Phenol, 3-(1H-imidazo[4,5-b]pyridin-2-yl)-2-methoxy-
CAS Number:
89469-37-4
Molecular Formula:
C13H11N3O2
Molecular Weight:
241.2453
IUPAC Name:
3-(1H-imidazo[4,5-b]pyridin-2-yl)-2-methoxyphenol
InChI:
InChI=1S/C13H11N3O2/c1-18-11-8(4-2-6-10(11)17)12-15-9-5-3-7-14-13(9)16-12/h2-7,17H,1H3,(H,14,15,16)
InChI Key:
AGOOMCFPQBTPLC-UHFFFAOYSA-N
SMILES:
COc1c(O)cccc1c1nc2c([nH]1)cccn2
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.085g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.25g/mol
Monoisotopic Mass:
241.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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