6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline

C260H180N12 — CID 159360093

IUPAC6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc4nc(-c5ccccc5)c(-c5ccc(-c6cccnc6)cc5)nc4cc3-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(-c3cc4nc(-c5ccccc5)c(-c5ccc(-c6ccncc6)cc5)nc4cc3-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.c1ccc(-c2nc3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3nc2-c2ccc(-c3ccccn3)cc2)cc1.c1ccc(-c2nc3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3nc2-c2ccc(-c3ccncc3)cc2)cc1
InChIInChI=1S/2C75H49N3.2C55H41N3/c1-6-22-51(23-7-1)72-73(52-39-37-50(38-40-52)69-36-20-21-45-76-69)78-71-49-64(54-42-44-62-60-33-17-19-35-66(60)75(68(62)47-54,57-28-12-4-13-29-57)58-30-14-5-15-31-58)63(48-70(71)77-72)53-41-43-61-59-32-16-18-34-65(59)74(67(61)46-53,55-24-8-2-9-25-55)56-26-10-3-11-27-56;1-6-20-52(21-7-1)72-73(53-36-34-50(35-37-53)51-42-44-76-45-43-51)78-71-49-65(55-39-41-63-61-31-17-19-33-67(61)75(69(63)47-55,58-26-12-4-13-27-58)59-28-14-5-15-29-59)64(48-70(71)77-72)54-38-40-62-60-30-16-18-32-66(60)74(68(62)46-54,56-22-8-2-9-23-56)57-24-10-3-11-25-57;1-54(2)46-18-10-8-16-40(46)42-26-24-37(29-48(42)54)44-31-50-51(32-45(44)38-25-27-43-41-17-9-11-19-47(41)55(3,4)49(43)30-38)58-53(52(57-50)35-13-6-5-7-14-35)36-22-20-34(21-23-36)39-15-12-28-56-33-39;1-54(2)46-16-10-8-14-40(46)42-24-22-38(30-48(42)54)44-32-50-51(33-45(44)39-23-25-43-41-15-9-11-17-47(41)55(3,4)49(43)31-39)58-53(52(57-50)36-12-6-5-7-13-36)37-20-18-34(19-21-37)35-26-28-56-29-27-35/h2*1-49H;2*5-33H,1-4H3
InChIKeyLIKUCMDFDFIIAM-UHFFFAOYSA-N
MW3472.38 g/mol
LogP64.12
Rot. Bonds28

About 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline

6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline (PubChem CID 159360093) has the molecular formula C260H180N12 and a molecular weight of 3472.38 g/mol. Its IUPAC name is 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline.

Molecular Properties

Compound Name6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline
PubChem CID159360093
Molecular FormulaC260H180N12
Molecular Weight3472.38 g/mol
Exact Mass3469.45
IUPAC Name6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc4nc(-c5ccccc5)c(-c5ccc(-c6cccnc6)cc5)nc4cc3-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(-c3cc4nc(-c5ccccc5)c(-c5ccc(-c6ccncc6)cc5)nc4cc3-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.c1ccc(-c2nc3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3nc2-c2ccc(-c3ccccn3)cc2)cc1.c1ccc(-c2nc3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3nc2-c2ccc(-c3ccncc3)cc2)cc1
InChIInChI=1S/2C75H49N3.2C55H41N3/c1-6-22-51(23-7-1)72-73(52-39-37-50(38-40-52)69-36-20-21-45-76-69)78-71-49-64(54-42-44-62-60-33-17-19-35-66(60)75(68(62)47-54,57-28-12-4-13-29-57)58-30-14-5-15-31-58)63(48-70(71)77-72)53-41-43-61-59-32-16-18-34-65(59)74(67(61)46-53,55-24-8-2-9-25-55)56-26-10-3-11-27-56;1-6-20-52(21-7-1)72-73(53-36-34-50(35-37-53)51-42-44-76-45-43-51)78-71-49-65(55-39-41-63-61-31-17-19-33-67(61)75(69(63)47-55,58-26-12-4-13-27-58)59-28-14-5-15-29-59)64(48-70(71)77-72)54-38-40-62-60-30-16-18-32-66(60)74(68(62)46-54,56-22-8-2-9-23-56)57-24-10-3-11-25-57;1-54(2)46-18-10-8-16-40(46)42-26-24-37(29-48(42)54)44-31-50-51(32-45(44)38-25-27-43-41-17-9-11-19-47(41)55(3,4)49(43)30-38)58-53(52(57-50)35-13-6-5-7-14-35)36-22-20-34(21-23-36)39-15-12-28-56-33-39;1-54(2)46-16-10-8-14-40(46)42-24-22-38(30-48(42)54)44-32-50-51(33-45(44)39-23-25-43-41-15-9-11-17-47(41)55(3,4)49(43)31-39)58-53(52(57-50)36-12-6-5-7-13-36)37-20-18-34(19-21-37)35-26-28-56-29-27-35/h2*1-49H;2*5-33H,1-4H3
InChIKeyLIKUCMDFDFIIAM-UHFFFAOYSA-N
XLogP64.12
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds28
Heavy Atoms272
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003472.38
LogP ≤ 564.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline?
The IUPAC name of 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline (CID 159360093) is 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline.
What is the SMILES notation for 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline?
The canonical SMILES for 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline is CC1(C)c2ccccc2-c2ccc(-c3cc4nc(-c5ccccc5)c(-c5ccc(-c6cccnc6)cc5)nc4cc3-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(-c3cc4nc(-c5ccccc5)c(-c5ccc(-c6ccncc6)cc5)nc4cc3-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.c1ccc(-c2nc3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3nc2-c2ccc(-c3ccccn3)cc2)cc1.c1ccc(-c2nc3cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3nc2-c2ccc(-c3ccncc3)cc2)cc1.
What is the InChIKey of 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline?
The InChIKey is LIKUCMDFDFIIAM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C75H49N3.2C55H41N3/c1-6-22-51(23-7-1)72-73(52-39-37-50(38-40-52)69-36-20-21-45-76-69)78-71-49-64(54-42-44-62-60-33-17-19-35-66(60)75(68(62)47-54,57-28-12-4-13-29-57)58-30-14-5-15-31-58)63(48-70(71)77-72)53-41-43-61-59-32-16-18-34-65(59)74(67(61)46-53,55-24-8-2-9-25-55)56-26-10-3-11-27-56;1-6-20-52(21-7-1)72-73(53-36-34-50(35-37-53)51-42-44-76-45-43-51)78-71-49-65(55-39-41-63-61-31-17-19-33-67(61)75(69(63)47-55,58-26-12-4-13-27-58)59-28-14-5-15-29-59)64(48-70(71)77-72)54-38-40-62-60-30-16-18-32-66(60)74(68(62)46-54,56-22-8-2-9-23-56)57-24-10-3-11-25-57;1-54(2)46-18-10-8-16-40(46)42-26-24-37(29-48(42)54)44-31-50-51(32-45(44)38-25-27-43-41-17-9-11-19-47(41)55(3,4)49(43)30-38)58-53(52(57-50)35-13-6-5-7-14-35)36-22-20-34(21-23-36)39-15-12-28-56-33-39;1-54(2)46-16-10-8-14-40(46)42-24-22-38(30-48(42)54)44-32-50-51(33-45(44)39-23-25-43-41-15-9-11-17-47(41)55(3,4)49(43)31-39)58-53(52(57-50)36-12-6-5-7-13-36)37-20-18-34(19-21-37)35-26-28-56-29-27-35/h2*1-49H;2*5-33H,1-4H3.
What are the key properties of 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline?
6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline has a molecular weight of 3472.38 g/mol, XLogP of 64.12, 28 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline is sourced from PubChem (CID 159360093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).