1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole

C171H112N14OS — CID 164989598

IUPAC1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole
SMILESCC1(C)c2ccc(-c3cccc4sc5ccccc5c34)cc2-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)n3)c21.CC1(C)c2ccccc2-c2c(-c3nc(-c4ccccc4)nc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)n3)cc(-c3ccc4oc5ccccc5c4c3)cc21.c1ccc(-c2nc(-c3ccc4c5c(-c6cccc7c6c6ccccc6n7-c6ccccc6)cccc5n(-c5ccccc5)c4c3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1
InChIInChI=1S/C63H40N6.C54H36N4O.C54H36N4S/c1-5-20-41(21-6-1)61-64-62(66-63(65-61)52-33-17-32-49-46-28-13-15-34-53(46)69(60(49)52)45-26-11-4-12-27-45)42-38-39-51-57(40-42)68(44-24-9-3-10-25-44)56-37-19-31-48(59(51)56)47-30-18-36-55-58(47)50-29-14-16-35-54(50)67(55)43-22-7-2-8-23-43;1-54(2)44-25-12-9-22-40(44)49-43(31-35(32-45(49)54)34-28-29-48-42(30-34)38-21-11-14-27-47(38)59-48)53-56-51(33-16-5-3-6-17-33)55-52(57-53)41-24-15-23-39-37-20-10-13-26-46(37)58(50(39)41)36-18-7-4-8-19-36;1-54(2)44-31-30-34(36-22-15-29-47-48(36)40-21-10-12-28-46(40)59-47)32-43(44)38-23-13-25-41(49(38)54)52-55-51(33-16-5-3-6-17-33)56-53(57-52)42-26-14-24-39-37-20-9-11-27-45(37)58(50(39)42)35-18-7-4-8-19-35/h1-40H;2*3-32H,1-2H3
InChIKeyGQXKDTMYEVYNTM-UHFFFAOYSA-N
MW2410.94 g/mol
LogP43.98
Rot. Bonds17

About 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole

1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 164989598) has the molecular formula C171H112N14OS and a molecular weight of 2410.94 g/mol. Its IUPAC name is 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole.

Molecular Properties

Compound Name1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole
PubChem CID164989598
Molecular FormulaC171H112N14OS
Molecular Weight2410.94 g/mol
Exact Mass2408.89
IUPAC Name1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole
SMILESCC1(C)c2ccc(-c3cccc4sc5ccccc5c34)cc2-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)n3)c21.CC1(C)c2ccccc2-c2c(-c3nc(-c4ccccc4)nc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)n3)cc(-c3ccc4oc5ccccc5c4c3)cc21.c1ccc(-c2nc(-c3ccc4c5c(-c6cccc7c6c6ccccc6n7-c6ccccc6)cccc5n(-c5ccccc5)c4c3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1
InChIInChI=1S/C63H40N6.C54H36N4O.C54H36N4S/c1-5-20-41(21-6-1)61-64-62(66-63(65-61)52-33-17-32-49-46-28-13-15-34-53(46)69(60(49)52)45-26-11-4-12-27-45)42-38-39-51-57(40-42)68(44-24-9-3-10-25-44)56-37-19-31-48(59(51)56)47-30-18-36-55-58(47)50-29-14-16-35-54(50)67(55)43-22-7-2-8-23-43;1-54(2)44-25-12-9-22-40(44)49-43(31-35(32-45(49)54)34-28-29-48-42(30-34)38-21-11-14-27-47(38)59-48)53-56-51(33-16-5-3-6-17-33)55-52(57-53)41-24-15-23-39-37-20-10-13-26-46(37)58(50(39)41)36-18-7-4-8-19-36;1-54(2)44-31-30-34(36-22-15-29-47-48(36)40-21-10-12-28-46(40)59-47)32-43(44)38-23-13-25-41(49(38)54)52-55-51(33-16-5-3-6-17-33)56-53(57-52)42-26-14-24-39-37-20-9-11-27-45(37)58(50(39)42)35-18-7-4-8-19-35/h1-40H;2*3-32H,1-2H3
InChIKeyGQXKDTMYEVYNTM-UHFFFAOYSA-N
XLogP43.98
TPSA153.80 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds17
Heavy Atoms187
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002410.94
LogP ≤ 543.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole with MolForge

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Related Compounds

12-(3-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzofuran-1-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzothiophen-1-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-4-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[3-(9-phenylcarbazol-1-yl)phenyl]indolo[2,3-a]carbazole;11-phenyl-12-[3-(9-phenylcarbazol-4-yl)phenyl]indolo[2,3-a]carbazole;11-phenyl-12-[4-(9-phenylcarbazol-1-yl)phenyl]indolo[2,3-a]carbazole
CID 158079729
2-[7-[9-[4-(7-dibenzothiophen-1-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 168768205
2-(4-dibenzofuran-2-yl-6-dibenzothiophen-1-yl-1,3,5-triazin-2-yl)-9-phenylcarbazole
CID 170534556
3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-[4-[3,5-bis(3-phenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole;3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-dimethylfluoren-2-yl]-9-phenylcarbazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-phenyl-3-[9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]carbazole;9-phenyl-2-[4-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 159897971
2-(8-dibenzothiophen-2-yldibenzothiophen-1-yl)-4,6-diphenyl-1,3,5-triazine;3-[1-(4,6-diphenylpyrimidin-2-yl)dibenzothiophen-3-yl]-9-phenylcarbazole;3-[1-(4,6-diphenylpyrimidin-2-yl)dibenzothiophen-4-yl]-9-phenylcarbazole;3-[8-[5-(4,6-diphenylpyrimidin-2-yl)-9,9-dimethylfluoren-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole;10-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 161147296
2-[7-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 168767810
3-[1-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[1-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[1-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-9-phenylcarbazole;4-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole
CID 167558053
2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenyl-6-(9-phenylcarbazol-4-yl)carbazole
CID 170240277
2-[4-([1]benzothiolo[3,2-a]carbazol-12-yl)-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[4-(7,7-dimethylindeno[1,2-a]carbazol-12-yl)-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine;2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-phenyl-[1]benzofuro[3,2-d]pyrimidine
CID 163597764
3-[9-[9-[4-(2-dibenzothiophen-1-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 168768814
2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 158529955
3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole;3-[5-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]-9,9-dimethylfluoren-3-yl]-9-phenylcarbazole;3-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-[4-(3,5-diphenylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;9-phenyl-3-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]carbazole
CID 159210179

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole?
The IUPAC name of 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole (CID 164989598) is 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole.
What is the SMILES notation for 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole?
The canonical SMILES for 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole is CC1(C)c2ccc(-c3cccc4sc5ccccc5c34)cc2-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)n3)c21.CC1(C)c2ccccc2-c2c(-c3nc(-c4ccccc4)nc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)n3)cc(-c3ccc4oc5ccccc5c4c3)cc21.c1ccc(-c2nc(-c3ccc4c5c(-c6cccc7c6c6ccccc6n7-c6ccccc6)cccc5n(-c5ccccc5)c4c3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1.
What is the InChIKey of 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole?
The InChIKey is GQXKDTMYEVYNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H40N6.C54H36N4O.C54H36N4S/c1-5-20-41(21-6-1)61-64-62(66-63(65-61)52-33-17-32-49-46-28-13-15-34-53(46)69(60(49)52)45-26-11-4-12-27-45)42-38-39-51-57(40-42)68(44-24-9-3-10-25-44)56-37-19-31-48(59(51)56)47-30-18-36-55-58(47)50-29-14-16-35-54(50)67(55)43-22-7-2-8-23-43;1-54(2)44-25-12-9-22-40(44)49-43(31-35(32-45(49)54)34-28-29-48-42(30-34)38-21-11-14-27-47(38)59-48)53-56-51(33-16-5-3-6-17-33)55-52(57-53)41-24-15-23-39-37-20-10-13-26-46(37)58(50(39)41)36-18-7-4-8-19-36;1-54(2)44-31-30-34(36-22-15-29-47-48(36)40-21-10-12-28-46(40)59-47)32-43(44)38-23-13-25-41(49(38)54)52-55-51(33-16-5-3-6-17-33)56-53(57-52)42-26-14-24-39-37-20-9-11-27-45(37)58(50(39)42)35-18-7-4-8-19-35/h1-40H;2*3-32H,1-2H3.
What are the key properties of 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole?
1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole has a molecular weight of 2410.94 g/mol, XLogP of 43.98, 17 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-dibenzofuran-2-yl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(6-dibenzothiophen-1-yl-9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-phenyl-5-(9-phenylcarbazol-4-yl)-2-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]carbazole is sourced from PubChem (CID 164989598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).