2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline

C143H85N9O6 — CID 161432167

IUPAC2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline
SMILESc1ccc(-c2ccc(-c3nc4ccccc4nc3-c3cccc4oc5ccccc5c34)c3ccccc23)cc1.c1ccc(-c2nc3cnccc3nc2-c2ccc(-c3cccc4oc5ccccc5c34)cc2)cc1.c1ccc2nc(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)c(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)nc2c1.c1ccc2nc(-c3cccc4oc5ccccc5c34)c(-c3cccc4oc5ccccc5c34)nc2c1
InChIInChI=1S/C44H26N2O2.C36H22N2O.C32H18N2O2.C31H19N3O/c1-5-15-37-33(9-1)41-31(11-7-17-39(41)47-37)27-19-23-29(24-20-27)43-44(46-36-14-4-3-13-35(36)45-43)30-25-21-28(22-26-30)32-12-8-18-40-42(32)34-10-2-6-16-38(34)48-40;1-2-11-23(12-3-1)24-21-22-27(26-14-5-4-13-25(24)26)35-36(38-31-18-8-7-17-30(31)37-35)29-16-10-20-33-34(29)28-15-6-9-19-32(28)39-33;1-5-15-25-19(9-1)29-21(11-7-17-27(29)35-25)31-32(34-24-14-4-3-13-23(24)33-31)22-12-8-18-28-30(22)20-10-2-6-16-26(20)36-28;1-2-7-21(8-3-1)30-31(33-25-17-18-32-19-26(25)34-30)22-15-13-20(14-16-22)23-10-6-12-28-29(23)24-9-4-5-11-27(24)35-28/h1-26H;1-22H;1-18H;1-19H
InChIKeyVYDZQFZLSICXGN-UHFFFAOYSA-N
MW2025.31 g/mol
LogP38.47
Rot. Bonds12

About 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline

2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline (PubChem CID 161432167) has the molecular formula C143H85N9O6 and a molecular weight of 2025.31 g/mol. Its IUPAC name is 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline.

Molecular Properties

Compound Name2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline
PubChem CID161432167
Molecular FormulaC143H85N9O6
Molecular Weight2025.31 g/mol
Exact Mass2023.66
IUPAC Name2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline
SMILESc1ccc(-c2ccc(-c3nc4ccccc4nc3-c3cccc4oc5ccccc5c34)c3ccccc23)cc1.c1ccc(-c2nc3cnccc3nc2-c2ccc(-c3cccc4oc5ccccc5c34)cc2)cc1.c1ccc2nc(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)c(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)nc2c1.c1ccc2nc(-c3cccc4oc5ccccc5c34)c(-c3cccc4oc5ccccc5c34)nc2c1
InChIInChI=1S/C44H26N2O2.C36H22N2O.C32H18N2O2.C31H19N3O/c1-5-15-37-33(9-1)41-31(11-7-17-39(41)47-37)27-19-23-29(24-20-27)43-44(46-36-14-4-3-13-35(36)45-43)30-25-21-28(22-26-30)32-12-8-18-40-42(32)34-10-2-6-16-38(34)48-40;1-2-11-23(12-3-1)24-21-22-27(26-14-5-4-13-25(24)26)35-36(38-31-18-8-7-17-30(31)37-35)29-16-10-20-33-34(29)28-15-6-9-19-32(28)39-33;1-5-15-25-19(9-1)29-21(11-7-17-27(29)35-25)31-32(34-24-14-4-3-13-23(24)33-31)22-12-8-18-28-30(22)20-10-2-6-16-26(20)36-28;1-2-7-21(8-3-1)30-31(33-25-17-18-32-19-26(25)34-30)22-15-13-20(14-16-22)23-10-6-12-28-29(23)24-9-4-5-11-27(24)35-28/h1-26H;1-22H;1-18H;1-19H
InChIKeyVYDZQFZLSICXGN-UHFFFAOYSA-N
XLogP38.47
TPSA194.85 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds12
Heavy Atoms158
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002025.31
LogP ≤ 538.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline?
The IUPAC name of 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline (CID 161432167) is 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline.
What is the SMILES notation for 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline?
The canonical SMILES for 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline is c1ccc(-c2ccc(-c3nc4ccccc4nc3-c3cccc4oc5ccccc5c34)c3ccccc23)cc1.c1ccc(-c2nc3cnccc3nc2-c2ccc(-c3cccc4oc5ccccc5c34)cc2)cc1.c1ccc2nc(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)c(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)nc2c1.c1ccc2nc(-c3cccc4oc5ccccc5c34)c(-c3cccc4oc5ccccc5c34)nc2c1.
What is the InChIKey of 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline?
The InChIKey is VYDZQFZLSICXGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H26N2O2.C36H22N2O.C32H18N2O2.C31H19N3O/c1-5-15-37-33(9-1)41-31(11-7-17-39(41)47-37)27-19-23-29(24-20-27)43-44(46-36-14-4-3-13-35(36)45-43)30-25-21-28(22-26-30)32-12-8-18-40-42(32)34-10-2-6-16-38(34)48-40;1-2-11-23(12-3-1)24-21-22-27(26-14-5-4-13-25(24)26)35-36(38-31-18-8-7-17-30(31)37-35)29-16-10-20-33-34(29)28-15-6-9-19-32(28)39-33;1-5-15-25-19(9-1)29-21(11-7-17-27(29)35-25)31-32(34-24-14-4-3-13-23(24)33-31)22-12-8-18-28-30(22)20-10-2-6-16-26(20)36-28;1-2-7-21(8-3-1)30-31(33-25-17-18-32-19-26(25)34-30)22-15-13-20(14-16-22)23-10-6-12-28-29(23)24-9-4-5-11-27(24)35-28/h1-26H;1-22H;1-18H;1-19H.
What are the key properties of 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline?
2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline has a molecular weight of 2025.31 g/mol, XLogP of 38.47, 12 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(4-dibenzofuran-1-ylphenyl)quinoxaline;2-dibenzofuran-1-yl-3-(4-phenylnaphthalen-1-yl)quinoxaline;2-(4-dibenzofuran-1-ylphenyl)-3-phenylpyrido[3,4-b]pyrazine;2,3-di(dibenzofuran-1-yl)quinoxaline is sourced from PubChem (CID 161432167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).