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Home > Imidazoles > 87967-71-3
87967-71-3 | 1H-Imidazo[4,5-f]quinoxaline, 7,8-diphenyl-
CAS No: 87967-71-3 Catalog No: AG004D2B MDL No:
Product Description
Catalog Number:
AG004D2B
Chemical Name:
1H-Imidazo[4,5-f]quinoxaline, 7,8-diphenyl-
CAS Number:
87967-71-3
Molecular Formula:
C21H14N4
Molecular Weight:
322.3627
IUPAC Name:
7,8-diphenyl-6H-imidazo[4,5-f]quinoxaline
InChI:
InChI=1S/C21H14N4/c1-3-7-14(8-4-1)18-19(15-9-5-2-6-10-15)25-21-17(24-18)12-11-16-20(21)23-13-22-16/h1-13,24H
InChI Key:
DJPCGZRSWBUQLF-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1nc2c(nc1c1ccccc1)ccc1c2[nH]cn1
Properties
Complexity:
751
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.122g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
322.371g/mol
Monoisotopic Mass:
322.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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