2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine

C184H112F8N20 — CID 157224899

IUPAC2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine
SMILESFC1(F)c2ccc(-c3cc(-c4ccc(-c5ccccn5)cc4)cc(-c4ccc(-c5ccccn5)cc4)c3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21.FC1(F)c2ccc(-c3cc(-c4ccccn4)cc(-c4ccccn4)c3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21.FC1(F)c2ccc(-c3cc(-c4ccccn4)cc(-c4ccccn4)n3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21.FC1(F)c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2cc(-c3nc4ccccc4c4ccccc34)ccc21
InChIInChI=1S/C56H35F2N5.C44H27F2N5.C43H26F2N6.C41H24F2N4/c57-56(58)49-27-25-42(34-47(49)48-35-43(26-28-50(48)56)55-62-53(40-11-3-1-4-12-40)61-54(63-55)41-13-5-2-6-14-41)46-32-44(36-17-21-38(22-18-36)51-15-7-9-29-59-51)31-45(33-46)37-19-23-39(24-20-37)52-16-8-10-30-60-52;45-44(46)37-19-17-30(32-23-33(39-15-7-9-21-47-39)25-34(24-32)40-16-8-10-22-48-40)26-35(37)36-27-31(18-20-38(36)44)43-50-41(28-11-3-1-4-12-28)49-42(51-43)29-13-5-2-6-14-29;44-43(45)34-19-17-29(38-25-31(36-15-7-9-21-46-36)26-39(48-38)37-16-8-10-22-47-37)23-32(34)33-24-30(18-20-35(33)43)42-50-40(27-11-3-1-4-12-27)49-41(51-42)28-13-5-2-6-14-28;42-41(43)34-21-19-27(37-31-17-8-7-15-29(31)30-16-9-10-18-36(30)44-37)23-32(34)33-24-28(20-22-35(33)41)40-46-38(25-11-3-1-4-12-25)45-39(47-40)26-13-5-2-6-14-26/h1-35H;1-27H;1-26H;1-24H
InChIKeyATKRTDMSJCJTIN-UHFFFAOYSA-N
MW2755.04 g/mol
LogP45.44
Rot. Bonds24

About 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine

2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 157224899) has the molecular formula C184H112F8N20 and a molecular weight of 2755.04 g/mol. Its IUPAC name is 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine
PubChem CID157224899
Molecular FormulaC184H112F8N20
Molecular Weight2755.04 g/mol
Exact Mass2752.93
IUPAC Name2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine
SMILESFC1(F)c2ccc(-c3cc(-c4ccc(-c5ccccn5)cc4)cc(-c4ccc(-c5ccccn5)cc4)c3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21.FC1(F)c2ccc(-c3cc(-c4ccccn4)cc(-c4ccccn4)c3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21.FC1(F)c2ccc(-c3cc(-c4ccccn4)cc(-c4ccccn4)n3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21.FC1(F)c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2cc(-c3nc4ccccc4c4ccccc34)ccc21
InChIInChI=1S/C56H35F2N5.C44H27F2N5.C43H26F2N6.C41H24F2N4/c57-56(58)49-27-25-42(34-47(49)48-35-43(26-28-50(48)56)55-62-53(40-11-3-1-4-12-40)61-54(63-55)41-13-5-2-6-14-41)46-32-44(36-17-21-38(22-18-36)51-15-7-9-29-59-51)31-45(33-46)37-19-23-39(24-20-37)52-16-8-10-30-60-52;45-44(46)37-19-17-30(32-23-33(39-15-7-9-21-47-39)25-34(24-32)40-16-8-10-22-48-40)26-35(37)36-27-31(18-20-38(36)44)43-50-41(28-11-3-1-4-12-28)49-42(51-43)29-13-5-2-6-14-29;44-43(45)34-19-17-29(38-25-31(36-15-7-9-21-46-36)26-39(48-38)37-16-8-10-22-47-37)23-32(34)33-24-30(18-20-35(33)43)42-50-40(27-11-3-1-4-12-27)49-41(51-42)28-13-5-2-6-14-28;42-41(43)34-21-19-27(37-31-17-8-7-15-29(31)30-16-9-10-18-36(30)44-37)23-32(34)33-24-28(20-22-35(33)41)40-46-38(25-11-3-1-4-12-25)45-39(47-40)26-13-5-2-6-14-26/h1-35H;1-27H;1-26H;1-24H
InChIKeyATKRTDMSJCJTIN-UHFFFAOYSA-N
XLogP45.44
TPSA257.80 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds24
Heavy Atoms212
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002755.04
LogP ≤ 545.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine with MolForge

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Related Compounds

CID 58731988
CID 58731988
9-[5-[2-Pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]pyridin-4-yl]pyridin-2-yl]pyrido[2,3-b]indole
CID 59609493
1-[4-(3,4-dihydro-2H-quinolin-1-yl)-6-[4-fluoro-6-(1,1,2,2,3,3-hexamethylinden-5-yl)-3-pyridinyl]-1,3,5-triazin-2-yl]-3,4-dihydro-2H-quinoline
CID 118857317
4-[4-[4,6-Bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]phenyl]-1-(2,2-difluoro-1,1,3,3-tetramethylinden-5-yl)isoquinoline
CID 118857336
9-[4-[1-(2,2-Difluoro-1,1,3,3-tetramethylinden-5-yl)isoquinolin-4-yl]-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 118857338
8-(4,6-Dicyclohexyl-1,3,5-triazin-2-yl)-5-(1,1,2,2,3,3-hexamethylinden-5-yl)-2-(trifluoromethyl)-1,6-naphthyridine
CID 118857470
2-[6-[4-[2-[3,5-Bis[2-[4-[5-[4,6-bis(1,1,2,2,2-pentafluoroethyl)-1,3,5-triazin-2-yl]-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]cyclohexa-1,3-dien-1-yl]-3-pyridinyl]-4,6-bis(1,1,2,2,2-pentafluoroethyl)-1,3,5-triazine
CID 122487893
8-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-(1,1,3,3-tetramethyl-2H-inden-5-yl)-2-(trifluoromethyl)-1,6-naphthyridine
CID 130376296
8-(4,6-Dinaphthalen-1-yl-1,3,5-triazin-2-yl)-5-(4-tricyclo[6.2.1.02,7]undeca-2(7),3,5-trienyl)-2-(trifluoromethyl)-1,6-naphthyridine
CID 130376298
8-(4,6-dicyclohexyl-1,3,5-triazin-2-yl)-5-(1,1,3,3-tetramethyl-2H-inden-5-yl)-2-(trifluoromethyl)-1,6-naphthyridine
CID 130376299
2-[6-[4-[2-[3,5-Bis[2-[4-[5-[4,6-bis(1,1,2,2,2-pentafluoroethyl)-1,3,5-triazin-2-yl]pyridin-2-yl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridin-3-yl]-4,6-bis(1,1,2,2,2-pentafluoroethyl)-1,3,5-triazine
CID 134191445
2-[6-[4-[2-[3,5-Bis[2-[4-[5-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]pyridin-2-yl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridin-3-yl]-4-methyl-6-(trifluoromethyl)pyrimidine
CID 134191452

Frequently Asked Questions

What is the IUPAC name of 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine (CID 157224899) is 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine is FC1(F)c2ccc(-c3cc(-c4ccc(-c5ccccn5)cc4)cc(-c4ccc(-c5ccccn5)cc4)c3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21.FC1(F)c2ccc(-c3cc(-c4ccccn4)cc(-c4ccccn4)c3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21.FC1(F)c2ccc(-c3cc(-c4ccccn4)cc(-c4ccccn4)n3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21.FC1(F)c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2cc(-c3nc4ccccc4c4ccccc34)ccc21.
What is the InChIKey of 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine?
The InChIKey is ATKRTDMSJCJTIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H35F2N5.C44H27F2N5.C43H26F2N6.C41H24F2N4/c57-56(58)49-27-25-42(34-47(49)48-35-43(26-28-50(48)56)55-62-53(40-11-3-1-4-12-40)61-54(63-55)41-13-5-2-6-14-41)46-32-44(36-17-21-38(22-18-36)51-15-7-9-29-59-51)31-45(33-46)37-19-23-39(24-20-37)52-16-8-10-30-60-52;45-44(46)37-19-17-30(32-23-33(39-15-7-9-21-47-39)25-34(24-32)40-16-8-10-22-48-40)26-35(37)36-27-31(18-20-38(36)44)43-50-41(28-11-3-1-4-12-28)49-42(51-43)29-13-5-2-6-14-29;44-43(45)34-19-17-29(38-25-31(36-15-7-9-21-46-36)26-39(48-38)37-16-8-10-22-47-37)23-32(34)33-24-30(18-20-35(33)43)42-50-40(27-11-3-1-4-12-27)49-41(51-42)28-13-5-2-6-14-28;42-41(43)34-21-19-27(37-31-17-8-7-15-29(31)30-16-9-10-18-36(30)44-37)23-32(34)33-24-28(20-22-35(33)41)40-46-38(25-11-3-1-4-12-25)45-39(47-40)26-13-5-2-6-14-26/h1-35H;1-27H;1-26H;1-24H.
What are the key properties of 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine?
2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine has a molecular weight of 2755.04 g/mol, XLogP of 45.44, 24 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-difluorofluoren-3-yl]phenanthridine;2-[6-(3,5-dipyridin-2-ylphenyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[6-(4,6-dipyridin-2-yl-2-pyridinyl)-9,9-difluorofluoren-3-yl]-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 157224899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).