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Home > Imidazoles > 89574-67-4
89574-67-4 | 1H-Imidazo[4,5-b]pyridine, 2-[3-(1-ethylbutoxy)-2-naphthalenyl]-
CAS No: 89574-67-4 Catalog No: AG003Z91 MDL No:
Product Description
Catalog Number:
AG003Z91
Chemical Name:
1H-Imidazo[4,5-b]pyridine, 2-[3-(1-ethylbutoxy)-2-naphthalenyl]-
CAS Number:
89574-67-4
Molecular Formula:
C22H23N3O
Molecular Weight:
345.4375
IUPAC Name:
2-(3-hexan-3-yloxynaphthalen-2-yl)-1H-imidazo[4,5-b]pyridine
InChI:
InChI=1S/C22H23N3O/c1-3-8-17(4-2)26-20-14-16-10-6-5-9-15(16)13-18(20)21-24-19-11-7-12-23-22(19)25-21/h5-7,9-14,17H,3-4,8H2,1-2H3,(H,23,24,25)
InChI Key:
GDIOCMUPOLHRSB-UHFFFAOYSA-N
SMILES:
CCCC(Oc1cc2ccccc2cc1c1nc2c([nH]1)cccn2)CC
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.184g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
345.446g/mol
Monoisotopic Mass:
345.184g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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