9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine

C166H107N11O — CID 159586792

IUPAC9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine
SMILESCC1(C)c2cc(-c3nc(-c4ccccc4)nc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)n3)ccc2-c2ccc3ccccc3c21.c1ccc(-c2cc(-c3ccc4c5ccccc5c5ccccc5c4c3)cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4c5ccccc5c(-c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7c6oc6ccccc67)cc45)c3)n2)cc1
InChIInChI=1S/C63H39N3O.C58H39N5.C45H29N3/c1-3-17-43(18-4-1)61-64-62(44-19-5-2-6-20-44)66-63(65-61)47-23-13-22-46(38-47)59-53-27-10-9-26-52(53)58(42-34-32-41(33-35-42)49-28-14-21-40-16-7-8-24-48(40)49)54-37-36-45(39-56(54)59)50-29-15-30-55-51-25-11-12-31-57(51)67-60(50)55;1-58(2)49-34-38(29-30-43(49)48-31-28-36-16-6-7-19-42(36)54(48)58)56-59-55(37-17-4-3-5-18-37)60-57(61-56)39-32-40(62-50-24-12-8-20-44(50)45-21-9-13-25-51(45)62)35-41(33-39)63-52-26-14-10-22-46(52)47-23-11-15-27-53(47)63;1-4-14-30(15-5-1)34-26-35(33-24-25-41-39-22-11-10-20-37(39)38-21-12-13-23-40(38)42(41)29-33)28-36(27-34)45-47-43(31-16-6-2-7-17-31)46-44(48-45)32-18-8-3-9-19-32/h1-39H;3-35H,1-2H3;1-29H
InChIKeyMJSJDMZQIUMCGD-UHFFFAOYSA-N
MW2271.76 g/mol
LogP43.09
Rot. Bonds17

About 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine

9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine (PubChem CID 159586792) has the molecular formula C166H107N11O and a molecular weight of 2271.76 g/mol. Its IUPAC name is 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine
PubChem CID159586792
Molecular FormulaC166H107N11O
Molecular Weight2271.76 g/mol
Exact Mass2269.87
IUPAC Name9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine
SMILESCC1(C)c2cc(-c3nc(-c4ccccc4)nc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)n3)ccc2-c2ccc3ccccc3c21.c1ccc(-c2cc(-c3ccc4c5ccccc5c5ccccc5c4c3)cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4c5ccccc5c(-c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7c6oc6ccccc67)cc45)c3)n2)cc1
InChIInChI=1S/C63H39N3O.C58H39N5.C45H29N3/c1-3-17-43(18-4-1)61-64-62(44-19-5-2-6-20-44)66-63(65-61)47-23-13-22-46(38-47)59-53-27-10-9-26-52(53)58(42-34-32-41(33-35-42)49-28-14-21-40-16-7-8-24-48(40)49)54-37-36-45(39-56(54)59)50-29-15-30-55-51-25-11-12-31-57(51)67-60(50)55;1-58(2)49-34-38(29-30-43(49)48-31-28-36-16-6-7-19-42(36)54(48)58)56-59-55(37-17-4-3-5-18-37)60-57(61-56)39-32-40(62-50-24-12-8-20-44(50)45-21-9-13-25-51(45)62)35-41(33-39)63-52-26-14-10-22-46(52)47-23-11-15-27-53(47)63;1-4-14-30(15-5-1)34-26-35(33-24-25-41-39-22-11-10-20-37(39)38-21-12-13-23-40(38)42(41)29-33)28-36(27-34)45-47-43(31-16-6-2-7-17-31)46-44(48-45)32-18-8-3-9-19-32/h1-39H;3-35H,1-2H3;1-29H
InChIKeyMJSJDMZQIUMCGD-UHFFFAOYSA-N
XLogP43.09
TPSA139.01 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds17
Heavy Atoms178
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002271.76
LogP ≤ 543.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine with MolForge

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Related Compounds

9-dibenzofuran-4-yl-11,11-dimethyl-5-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indeno[1,2-b]carbazole
CID 130209419
9-dibenzofuran-4-yl-7,7-dimethyl-5-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indeno[2,1-b]carbazole
CID 130209455
7-(4-dibenzofuran-4-ylphenyl)-5-(11,11-dimethylbenzo[a]fluoren-9-yl)indolo[2,3-b]carbazole
CID 126580144
5-[3-dibenzofuran-4-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7,7-dimethylindeno[2,1-b]carbazole
CID 146534938
4-[3-(3-carbazol-9-ylcarbazol-9-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile
CID 161328818
9-(9,9-dimethyl-7-phenylfluoren-2-yl)-10-phenylanthracene;9-(2,3,4,5,6-pentadeuteriophenyl)-10-phenanthren-9-ylanthracene;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;4-[3-(10-phenylanthracen-9-yl)phenyl]dibenzofuran;4-[4-(10-phenylanthracen-9-yl)phenyl]dibenzofuran
CID 157368151
3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-(6-phenyldibenzofuran-2-yl)carbazole
CID 170080701
9-[3-(12,12-dimethylfluoreno[1,2-b][1]benzofuran-2-yl)phenyl]-3,6-diphenylcarbazole
CID 118098908
2-(4-dibenzofuran-4-ylphenyl)-4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazine;3-[4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethyl-2,7-diphenylfluoren-4-yl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 157129034
4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine
CID 159282220
9-[9,10-bis(9,9-dimethylfluoren-2-yl)anthracen-2-yl]-3-dibenzofuran-4-ylcarbazole
CID 87156778
9-[3-carbazol-9-yl-5-(6-dibenzofuran-3-yl-2-phenylpyrimidin-4-yl)phenyl]carbazole;9-[3-carbazol-9-yl-5-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]carbazole;9-[3-carbazol-9-yl-5-(6-naphthalen-1-yl-2-phenylpyrimidin-4-yl)phenyl]carbazole
CID 167665643

Frequently Asked Questions

What is the IUPAC name of 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine?
The IUPAC name of 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine (CID 159586792) is 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine.
What is the SMILES notation for 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine?
The canonical SMILES for 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine is CC1(C)c2cc(-c3nc(-c4ccccc4)nc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)n3)ccc2-c2ccc3ccccc3c21.c1ccc(-c2cc(-c3ccc4c5ccccc5c5ccccc5c4c3)cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4c5ccccc5c(-c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7c6oc6ccccc67)cc45)c3)n2)cc1.
What is the InChIKey of 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine?
The InChIKey is MJSJDMZQIUMCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H39N3O.C58H39N5.C45H29N3/c1-3-17-43(18-4-1)61-64-62(44-19-5-2-6-20-44)66-63(65-61)47-23-13-22-46(38-47)59-53-27-10-9-26-52(53)58(42-34-32-41(33-35-42)49-28-14-21-40-16-7-8-24-48(40)49)54-37-36-45(39-56(54)59)50-29-15-30-55-51-25-11-12-31-57(51)67-60(50)55;1-58(2)49-34-38(29-30-43(49)48-31-28-36-16-6-7-19-42(36)54(48)58)56-59-55(37-17-4-3-5-18-37)60-57(61-56)39-32-40(62-50-24-12-8-20-44(50)45-21-9-13-25-51(45)62)35-41(33-39)63-52-26-14-10-22-46(52)47-23-11-15-27-53(47)63;1-4-14-30(15-5-1)34-26-35(33-24-25-41-39-22-11-10-20-37(39)38-21-12-13-23-40(38)42(41)29-33)28-36(27-34)45-47-43(31-16-6-2-7-17-31)46-44(48-45)32-18-8-3-9-19-32/h1-39H;3-35H,1-2H3;1-29H.
What are the key properties of 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine?
9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine has a molecular weight of 2271.76 g/mol, XLogP of 43.09, 17 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-carbazol-9-yl-5-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[3-[2-dibenzofuran-4-yl-10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine is sourced from PubChem (CID 159586792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).