9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole

C228H139N15O — CID 158233109

IUPAC9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole
SMILESc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c4c(-c5nc(-c6ccccc6)nc(-c6ccc7c8ccccc8c8ccccc8c7c6)n5)cccc4c4ccccc4c23)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c4cc(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)ccc4c4ccccc4c23)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c4cccc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)c4c4ccccc4c23)cc1.c1ccc(-c2nc(-c3ccc4c(c3)c3ccccc3c3c(-n5c6ccccc6c6cc7c8ccccc8n(-c8ccccc8)c7cc65)cccc43)nc3ccccc23)cc1
InChIInChI=1S/C63H38N4.C57H34N4O.C56H34N4.C52H33N3/c1-3-17-39(18-4-1)41-34-36-57-55(37-41)49-26-13-14-31-56(49)67(57)58-32-16-29-52-59-50(47-25-11-12-27-51(47)60(52)58)28-15-30-53(59)63-65-61(40-19-5-2-6-20-40)64-62(66-63)42-33-35-48-45-23-8-7-21-43(45)44-22-9-10-24-46(44)54(48)38-42;1-3-15-35(16-4-1)37-30-32-49-47(33-37)41-20-9-11-25-48(41)61(49)50-26-13-23-43-46-34-38(29-31-40(46)39-19-7-8-21-42(39)53(43)50)56-58-55(36-17-5-2-6-18-36)59-57(60-56)45-24-14-28-52-54(45)44-22-10-12-27-51(44)62-52;1-3-16-35(17-4-1)55-44-24-9-12-26-48(44)57-56(58-55)36-30-31-39-43-25-15-29-51(54(43)42-23-8-7-20-38(42)45(39)32-36)60-50-28-14-11-22-41(50)47-33-46-40-21-10-13-27-49(40)59(52(46)34-53(47)60)37-18-5-2-6-19-37;1-4-16-34(17-5-1)37-30-31-48-44(32-37)38-22-12-13-28-47(38)55(48)49-29-15-26-42-40-25-14-27-43(50(40)39-23-10-11-24-41(39)51(42)49)52-53-45(35-18-6-2-7-19-35)33-46(54-52)36-20-8-3-9-21-36/h1-38H;1-34H;1-34H;1-33H
InChIKeyGEPYAWQRUCDLDV-UHFFFAOYSA-N
MW3104.72 g/mol
LogP59.87
Rot. Bonds19

About 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole

9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole (PubChem CID 158233109) has the molecular formula C228H139N15O and a molecular weight of 3104.72 g/mol. Its IUPAC name is 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole.

Molecular Properties

Compound Name9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole
PubChem CID158233109
Molecular FormulaC228H139N15O
Molecular Weight3104.72 g/mol
Exact Mass3102.13
IUPAC Name9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole
SMILESc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c4c(-c5nc(-c6ccccc6)nc(-c6ccc7c8ccccc8c8ccccc8c7c6)n5)cccc4c4ccccc4c23)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c4cc(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)ccc4c4ccccc4c23)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c4cccc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)c4c4ccccc4c23)cc1.c1ccc(-c2nc(-c3ccc4c(c3)c3ccccc3c3c(-n5c6ccccc6c6cc7c8ccccc8n(-c8ccccc8)c7cc65)cccc43)nc3ccccc23)cc1
InChIInChI=1S/C63H38N4.C57H34N4O.C56H34N4.C52H33N3/c1-3-17-39(18-4-1)41-34-36-57-55(37-41)49-26-13-14-31-56(49)67(57)58-32-16-29-52-59-50(47-25-11-12-27-51(47)60(52)58)28-15-30-53(59)63-65-61(40-19-5-2-6-20-40)64-62(66-63)42-33-35-48-45-23-8-7-21-43(45)44-22-9-10-24-46(44)54(48)38-42;1-3-15-35(16-4-1)37-30-32-49-47(33-37)41-20-9-11-25-48(41)61(49)50-26-13-23-43-46-34-38(29-31-40(46)39-19-7-8-21-42(39)53(43)50)56-58-55(36-17-5-2-6-18-36)59-57(60-56)45-24-14-28-52-54(45)44-22-10-12-27-51(44)62-52;1-3-16-35(17-4-1)55-44-24-9-12-26-48(44)57-56(58-55)36-30-31-39-43-25-15-29-51(54(43)42-23-8-7-20-38(42)45(39)32-36)60-50-28-14-11-22-41(50)47-33-46-40-21-10-13-27-49(40)59(52(46)34-53(47)60)37-18-5-2-6-19-37;1-4-16-34(17-5-1)37-30-31-48-44(32-37)38-22-12-13-28-47(38)55(48)49-29-15-26-42-40-25-14-27-43(50(40)39-23-10-11-24-41(39)51(42)49)52-53-45(35-18-6-2-7-19-35)33-46(54-52)36-20-8-3-9-21-36/h1-38H;1-34H;1-34H;1-33H
InChIKeyGEPYAWQRUCDLDV-UHFFFAOYSA-N
XLogP59.87
TPSA166.69 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds19
Heavy Atoms244
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003104.72
LogP ≤ 559.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole with MolForge

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Related Compounds

17-[4-[6-(3-dibenzofuran-1-ylphenyl)-2-phenylpyrimidin-4-yl]phenyl]-10,21-diphenyl-10,20-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene
CID 166584667
3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine
CID 165008539
9-(3-phenylphenyl)-3-[9-[4-(3-phenylphenyl)quinazolin-2-yl]dibenzofuran-3-yl]carbazole
CID 134594925
9-phenyl-3-[9-(2-phenylquinazolin-4-yl)dibenzofuran-2-yl]carbazole
CID 134594831
3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenyl-6-triphenylen-1-ylcarbazole
CID 154602338
3-[9-[3-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 118888276
3-[8-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 139338453
3-dibenzofuran-2-yl-9-[9-(2-phenylquinazolin-4-yl)dibenzofuran-3-yl]carbazole;2,7-diphenyl-9-[9-(2-phenylquinazolin-4-yl)dibenzofuran-3-yl]carbazole;3,6-diphenyl-9-[9-(2-phenylquinazolin-4-yl)dibenzofuran-3-yl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[9-(2-phenylquinazolin-4-yl)dibenzofuran-3-yl]carbazole
CID 158774380
9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole
CID 160507007
5-phenyl-11-[9-(4-phenylquinazolin-2-yl)dibenzofuran-3-yl]indolo[3,2-b]carbazole
CID 146334039
3-[9-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-3-yl]carbazol-3-yl]-9-phenylcarbazole
CID 146334319
9-dibenzofuran-1-yl-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole
CID 139568398

Frequently Asked Questions

What is the IUPAC name of 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole?
The IUPAC name of 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole (CID 158233109) is 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole.
What is the SMILES notation for 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole?
The canonical SMILES for 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole is c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c4c(-c5nc(-c6ccccc6)nc(-c6ccc7c8ccccc8c8ccccc8c7c6)n5)cccc4c4ccccc4c23)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c4cc(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)ccc4c4ccccc4c23)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c4cccc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)c4c4ccccc4c23)cc1.c1ccc(-c2nc(-c3ccc4c(c3)c3ccccc3c3c(-n5c6ccccc6c6cc7c8ccccc8n(-c8ccccc8)c7cc65)cccc43)nc3ccccc23)cc1.
What is the InChIKey of 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole?
The InChIKey is GEPYAWQRUCDLDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H38N4.C57H34N4O.C56H34N4.C52H33N3/c1-3-17-39(18-4-1)41-34-36-57-55(37-41)49-26-13-14-31-56(49)67(57)58-32-16-29-52-59-50(47-25-11-12-27-51(47)60(52)58)28-15-30-53(59)63-65-61(40-19-5-2-6-20-40)64-62(66-63)42-33-35-48-45-23-8-7-21-43(45)44-22-9-10-24-46(44)54(48)38-42;1-3-15-35(16-4-1)37-30-32-49-47(33-37)41-20-9-11-25-48(41)61(49)50-26-13-23-43-46-34-38(29-31-40(46)39-19-7-8-21-42(39)53(43)50)56-58-55(36-17-5-2-6-18-36)59-57(60-56)45-24-14-28-52-54(45)44-22-10-12-27-51(44)62-52;1-3-16-35(17-4-1)55-44-24-9-12-26-48(44)57-56(58-55)36-30-31-39-43-25-15-29-51(54(43)42-23-8-7-20-38(42)45(39)32-36)60-50-28-14-11-22-41(50)47-33-46-40-21-10-13-27-49(40)59(52(46)34-53(47)60)37-18-5-2-6-19-37;1-4-16-34(17-5-1)37-30-31-48-44(32-37)38-22-12-13-28-47(38)55(48)49-29-15-26-42-40-25-14-27-43(50(40)39-23-10-11-24-41(39)51(42)49)52-53-45(35-18-6-2-7-19-35)33-46(54-52)36-20-8-3-9-21-36/h1-38H;1-34H;1-34H;1-33H.
What are the key properties of 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole?
9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole has a molecular weight of 3104.72 g/mol, XLogP of 59.87, 19 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;9-[8-(4,6-diphenylpyrimidin-2-yl)triphenylen-1-yl]-3-phenylcarbazole;7-phenyl-5-[7-(4-phenylquinazolin-2-yl)triphenylen-1-yl]indolo[2,3-b]carbazole;3-phenyl-9-[5-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)triphenylen-1-yl]carbazole is sourced from PubChem (CID 158233109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).