9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole

C147H92N12OS — CID 159159412

IUPAC9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole
SMILESc1ccc(-c2ccc3c(c2)c2c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2ccc3oc4ccccc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2cccc(-c3ccc4c5ccccc5c5ccccc5c4c3)c2)cc1
InChIInChI=1S/C57H36N4.C45H28N4O.C45H28N4S/c1-4-16-37(17-5-1)41-31-33-52-51(36-41)54-49(57-59-55(38-18-6-2-7-19-38)58-56(60-57)39-20-8-3-9-21-39)28-15-29-53(54)61(52)43-23-14-22-40(34-43)42-30-32-48-46-26-11-10-24-44(46)45-25-12-13-27-47(45)50(48)35-42;2*1-4-13-29(14-5-1)32-23-25-38-37(27-32)42-35(45-47-43(30-15-6-2-7-16-30)46-44(48-45)31-17-8-3-9-18-31)20-12-21-39(42)49(38)33-24-26-41-36(28-33)34-19-10-11-22-40(34)50-41/h1-36H;2*1-28H
InChIKeyKKHOYODINBPDOZ-UHFFFAOYSA-N
MW2074.50 g/mol
LogP38.30
Rot. Bonds16

About 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole

9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole (PubChem CID 159159412) has the molecular formula C147H92N12OS and a molecular weight of 2074.50 g/mol. Its IUPAC name is 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole.

Molecular Properties

Compound Name9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole
PubChem CID159159412
Molecular FormulaC147H92N12OS
Molecular Weight2074.50 g/mol
Exact Mass2072.72
IUPAC Name9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole
SMILESc1ccc(-c2ccc3c(c2)c2c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2ccc3oc4ccccc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2cccc(-c3ccc4c5ccccc5c5ccccc5c4c3)c2)cc1
InChIInChI=1S/C57H36N4.C45H28N4O.C45H28N4S/c1-4-16-37(17-5-1)41-31-33-52-51(36-41)54-49(57-59-55(38-18-6-2-7-19-38)58-56(60-57)39-20-8-3-9-21-39)28-15-29-53(54)61(52)43-23-14-22-40(34-43)42-30-32-48-46-26-11-10-24-44(46)45-25-12-13-27-47(45)50(48)35-42;2*1-4-13-29(14-5-1)32-23-25-38-37(27-32)42-35(45-47-43(30-15-6-2-7-16-30)46-44(48-45)31-17-8-3-9-18-31)20-12-21-39(42)49(38)33-24-26-41-36(28-33)34-19-10-11-22-40(34)50-41/h1-36H;2*1-28H
InChIKeyKKHOYODINBPDOZ-UHFFFAOYSA-N
XLogP38.30
TPSA143.94 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds16
Heavy Atoms161
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002074.50
LogP ≤ 538.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

Analyze 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole with MolForge

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Related Compounds

3-dibenzofuran-2-yl-9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;3-dibenzothiophen-2-yl-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;3-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazol-3-yl]-9-phenylcarbazole;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2,7-diphenylcarbazole;9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-phenylcarbazole
CID 159615969
3-[9-(4-dibenzothiophen-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 129291947
9-[3-[4-(8-dibenzothiophen-2-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 162780092
3-[8-[9-[4-(7-carbazol-9-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]dibenzothiophen-3-yl]-9-phenylcarbazole
CID 168768676
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 158229198
9-dibenzofuran-2-yl-3-dibenzothiophen-2-ylcarbazole;3-dibenzofuran-2-yl-9-(3-phenylphenyl)carbazole;3,9-di(dibenzothiophen-2-yl)carbazole
CID 158258330
3-dibenzofuran-2-yl-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazole
CID 160542300
4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-dibenzofuran-2-ylcarbazole
CID 139556325
9-[8-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]dibenzothiophen-2-yl]carbazole
CID 169011395
9-[9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]dibenzothiophen-2-yl]-3-(3-phenylphenyl)carbazole
CID 165166733
3-carbazol-9-yl-9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazole;3-(9-dibenzothiophen-2-ylcarbazol-4-yl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 161317954
9-[9-[4-dibenzothiophen-1-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-3-phenylcarbazole
CID 166913990

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole?
The IUPAC name of 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole (CID 159159412) is 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole.
What is the SMILES notation for 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole?
The canonical SMILES for 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole is c1ccc(-c2ccc3c(c2)c2c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2ccc3oc4ccccc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2cccc(-c3ccc4c5ccccc5c5ccccc5c4c3)c2)cc1.
What is the InChIKey of 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole?
The InChIKey is KKHOYODINBPDOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H36N4.C45H28N4O.C45H28N4S/c1-4-16-37(17-5-1)41-31-33-52-51(36-41)54-49(57-59-55(38-18-6-2-7-19-38)58-56(60-57)39-20-8-3-9-21-39)28-15-29-53(54)61(52)43-23-14-22-40(34-43)42-30-32-48-46-26-11-10-24-44(46)45-25-12-13-27-47(45)50(48)35-42;2*1-4-13-29(14-5-1)32-23-25-38-37(27-32)42-35(45-47-43(30-15-6-2-7-16-30)46-44(48-45)31-17-8-3-9-18-31)20-12-21-39(42)49(38)33-24-26-41-36(28-33)34-19-10-11-22-40(34)50-41/h1-36H;2*1-28H.
What are the key properties of 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole?
9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole has a molecular weight of 2074.50 g/mol, XLogP of 38.30, 16 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;9-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-9-(3-triphenylen-2-ylphenyl)carbazole is sourced from PubChem (CID 159159412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).