2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline

C27H15FN4O — CID 164826444

IUPAC2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline
SMILESFc1ccc2c(c1)oc1c(-c3nc4nc5ccccc5nc4n3-c3ccccc3)cccc12
InChIInChI=1S/C27H15FN4O/c28-16-13-14-18-19-9-6-10-20(24(19)33-23(18)15-16)26-31-25-27(32(26)17-7-2-1-3-8-17)30-22-12-5-4-11-21(22)29-25/h1-15H
InChIKeyDOERGYXUMBDFMC-UHFFFAOYSA-N
MW430.44 g/mol
LogP6.67
Rot. Bonds2

About 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline

2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline (PubChem CID 164826444) has the molecular formula C27H15FN4O and a molecular weight of 430.44 g/mol. Its IUPAC name is 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline.

Molecular Properties

Compound Name2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline
PubChem CID164826444
Molecular FormulaC27H15FN4O
Molecular Weight430.44 g/mol
Exact Mass430.12
IUPAC Name2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline
SMILESFc1ccc2c(c1)oc1c(-c3nc4nc5ccccc5nc4n3-c3ccccc3)cccc12
InChIInChI=1S/C27H15FN4O/c28-16-13-14-18-19-9-6-10-20(24(19)33-23(18)15-16)26-31-25-27(32(26)17-7-2-1-3-8-17)30-22-12-5-4-11-21(22)29-25/h1-15H
InChIKeyDOERGYXUMBDFMC-UHFFFAOYSA-N
XLogP6.67
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.44
LogP ≤ 56.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(7-fluorodibenzofuran-4-yl)-4-methyl-1-phenylimidazo[4,5-c]quinoline
CID 164826973
2-(7-fluorodibenzofuran-4-yl)-6-methyl-1-phenylimidazo[4,5-c]pyridine
CID 164827019
3-phenyl-2-(7-phenyldibenzofuran-4-yl)imidazo[4,5-b]quinoline
CID 164825385
6-tert-butyl-2-dibenzofuran-4-yl-1-phenylimidazo[4,5-b]pyridine
CID 164826557
[6-(6-tert-butyl-1-phenylimidazo[4,5-b]pyridin-2-yl)dibenzofuran-3-yl]-trimethylsilane
CID 164826115
5-methyl-1-phenyl-2-(7-phenyldibenzofuran-4-yl)imidazo[4,5-b]pyridine
CID 164824506
3-(4-fluorophenyl)-2-phenylimidazo[4,5-b]quinoxaline
CID 921658
6-[7-(2-deuteriopropan-2-yl)dibenzofuran-4-yl]-7-phenylimidazo[4,5-e][1,2,4]triazine
CID 164825846
1-[2,6-di(propan-2-yl)phenyl]-2-(7-fluorodibenzofuran-4-yl)benzo[e]benzimidazole
CID 162776925
2-(4-dibenzofuran-4-yl-2,5-dimethylphenyl)-1-phenylbenzimidazole
CID 58309657
6-methyl-1-phenyl-2-(7-phenyldibenzofuran-4-yl)imidazo[4,5-b]pyridine
CID 164826959
2-[7-(2-deuteriopropan-2-yl)dibenzofuran-4-yl]-1-phenylimidazo[4,5-c]isoquinoline
CID 164824328

Frequently Asked Questions

What is the IUPAC name of 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline?
The IUPAC name of 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline (CID 164826444) is 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline.
What is the SMILES notation for 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline?
The canonical SMILES for 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline is Fc1ccc2c(c1)oc1c(-c3nc4nc5ccccc5nc4n3-c3ccccc3)cccc12.
What is the InChIKey of 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline?
The InChIKey is DOERGYXUMBDFMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H15FN4O/c28-16-13-14-18-19-9-6-10-20(24(19)33-23(18)15-16)26-31-25-27(32(26)17-7-2-1-3-8-17)30-22-12-5-4-11-21(22)29-25/h1-15H.
What are the key properties of 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline?
2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline has a molecular weight of 430.44 g/mol, XLogP of 6.67, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-fluorodibenzofuran-4-yl)-3-phenylimidazo[4,5-b]quinoxaline is sourced from PubChem (CID 164826444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).