3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine

C332H202N22O3S5 — CID 160893778

IUPAC3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)nc(-c4cccc5sc6ccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)cc6c45)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cccc5sc6ccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)cc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)nc(-c3cccc4sc5ccccc5c34)n2)cc1.c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5ccc(-c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5ccc(-c6cccc7c6-c6ccccc6C76c7ccccc7-c7ccccc76)cc5c34)n2)cc1
InChIInChI=1S/C69H44N4S.C57H36N4S.2C52H31N3S.C51H30N4O2.C51H30N4OS/c1-6-19-45(20-7-1)51-37-52(46-21-8-2-9-22-46)40-55(39-51)67-70-68(56-41-53(47-23-10-3-11-24-47)38-54(42-56)48-25-12-4-13-26-48)72-69(71-67)59-30-18-32-65-66(59)61-44-50(34-36-64(61)74-65)49-33-35-63-60(43-49)58-29-16-17-31-62(58)73(63)57-27-14-5-15-28-57;1-4-15-37(16-5-1)39-19-12-21-43(33-39)55-58-56(44-22-13-20-40(34-44)38-17-6-2-7-18-38)60-57(59-55)47-26-14-28-53-54(47)49-36-42(30-32-52(49)62-53)41-29-31-51-48(35-41)46-25-10-11-27-50(46)61(51)45-23-8-3-9-24-45;1-3-15-32(16-4-1)49-53-50(33-17-5-2-6-18-33)55-51(54-49)39-23-14-28-46-48(39)40-31-34(29-30-45(40)56-46)35-22-13-27-44-47(35)38-21-9-12-26-43(38)52(44)41-24-10-7-19-36(41)37-20-8-11-25-42(37)52;1-3-14-32(15-4-1)49-53-50(33-16-5-2-6-17-33)55-51(54-49)40-21-13-25-47-48(40)41-30-34(27-29-46(41)56-47)35-26-28-39-38-20-9-12-24-44(38)52(45(39)31-35)42-22-10-7-18-36(42)37-19-8-11-23-43(37)52;1-3-13-31(14-4-1)49-52-50(37-19-11-23-45-47(37)36-18-8-10-22-43(36)56-45)54-51(53-49)38-20-12-24-46-48(38)40-30-33(26-28-44(40)57-46)32-25-27-42-39(29-32)35-17-7-9-21-41(35)55(42)34-15-5-2-6-16-34;1-3-13-31(14-4-1)49-52-50(54-51(53-49)38-20-12-24-46-48(38)36-18-8-10-23-45(36)57-46)37-19-11-22-44-47(37)40-30-33(26-28-43(40)56-44)32-25-27-42-39(29-32)35-17-7-9-21-41(35)55(42)34-15-5-2-6-16-34/h1-44H;1-36H;2*1-31H;2*1-30H
InChIKeySOPKTGRIGNRTSM-UHFFFAOYSA-N
MW4707.75 g/mol
LogP87.85
Rot. Bonds34

About 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine

3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine (PubChem CID 160893778) has the molecular formula C332H202N22O3S5 and a molecular weight of 4707.75 g/mol. Its IUPAC name is 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine.

Molecular Properties

Compound Name3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine
PubChem CID160893778
Molecular FormulaC332H202N22O3S5
Molecular Weight4707.75 g/mol
Exact Mass4703.49
IUPAC Name3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)nc(-c4cccc5sc6ccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)cc6c45)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cccc5sc6ccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)cc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)nc(-c3cccc4sc5ccccc5c34)n2)cc1.c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5ccc(-c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5ccc(-c6cccc7c6-c6ccccc6C76c7ccccc7-c7ccccc76)cc5c34)n2)cc1
InChIInChI=1S/C69H44N4S.C57H36N4S.2C52H31N3S.C51H30N4O2.C51H30N4OS/c1-6-19-45(20-7-1)51-37-52(46-21-8-2-9-22-46)40-55(39-51)67-70-68(56-41-53(47-23-10-3-11-24-47)38-54(42-56)48-25-12-4-13-26-48)72-69(71-67)59-30-18-32-65-66(59)61-44-50(34-36-64(61)74-65)49-33-35-63-60(43-49)58-29-16-17-31-62(58)73(63)57-27-14-5-15-28-57;1-4-15-37(16-5-1)39-19-12-21-43(33-39)55-58-56(44-22-13-20-40(34-44)38-17-6-2-7-18-38)60-57(59-55)47-26-14-28-53-54(47)49-36-42(30-32-52(49)62-53)41-29-31-51-48(35-41)46-25-10-11-27-50(46)61(51)45-23-8-3-9-24-45;1-3-15-32(16-4-1)49-53-50(33-17-5-2-6-18-33)55-51(54-49)39-23-14-28-46-48(39)40-31-34(29-30-45(40)56-46)35-22-13-27-44-47(35)38-21-9-12-26-43(38)52(44)41-24-10-7-19-36(41)37-20-8-11-25-42(37)52;1-3-14-32(15-4-1)49-53-50(33-16-5-2-6-17-33)55-51(54-49)40-21-13-25-47-48(40)41-30-34(27-29-46(41)56-47)35-26-28-39-38-20-9-12-24-44(38)52(45(39)31-35)42-22-10-7-18-36(42)37-19-8-11-23-43(37)52;1-3-13-31(14-4-1)49-52-50(37-19-11-23-45-47(37)36-18-8-10-22-43(36)56-45)54-51(53-49)38-20-12-24-46-48(38)40-30-33(26-28-44(40)57-46)32-25-27-42-39(29-32)35-17-7-9-21-41(35)55(42)34-15-5-2-6-16-34;1-3-13-31(14-4-1)49-52-50(54-51(53-49)38-20-12-24-46-48(38)36-18-8-10-23-45(36)57-46)37-19-11-22-44-47(37)40-30-33(26-28-43(40)56-44)32-25-27-42-39(29-32)35-17-7-9-21-41(35)55(42)34-15-5-2-6-16-34/h1-44H;1-36H;2*1-31H;2*1-30H
InChIKeySOPKTGRIGNRTSM-UHFFFAOYSA-N
XLogP87.85
TPSA291.16 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds34
Heavy Atoms362
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004707.75
LogP ≤ 587.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine with MolForge

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Related Compounds

3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)carbazole
CID 129291968
3-[9-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-(9,9'-spirobi[fluorene]-2-yl)carbazole
CID 154602202
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-[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
3-dibenzofuran-1-yl-6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-9-phenylcarbazole;3-dibenzofuran-2-yl-6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-9-phenylcarbazole;3-dibenzofuran-4-yl-6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-9-phenylcarbazole;3-(3,5-diphenylphenyl)-6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-6,9-diphenylcarbazole;8-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-5-phenylpyrido[3,2-b]indole;8-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-5-phenylpyrimido[5,4-b]indole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-9-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)carbazole
CID 161235535
3-[8-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole
CID 168768786
3-dibenzofuran-3-yl-5,9-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-3-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole;3-dibenzothiophen-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole;3-(9,9-diphenylfluoren-2-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenyl-3-(9,9'-spirobi[fluorene]-2-yl)carbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenyl-3-(9,9'-spirobi[fluorene]-4'-yl)carbazole
CID 161433846
2-dibenzothiophen-1-yl-4-[8-[3-(9,9-diphenylfluoren-4-yl)phenyl]dibenzofuran-1-yl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 153369515
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
3-[9-(4-dibenzothiophen-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 129291947
2,4-di(dibenzothiophen-1-yl)-6-[8-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine
CID 156734754
2,4-di(dibenzothiophen-1-yl)-6-[8-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine
CID 156734762

Frequently Asked Questions

What is the IUPAC name of 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine?
The IUPAC name of 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine (CID 160893778) is 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine.
What is the SMILES notation for 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine?
The canonical SMILES for 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine is c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)nc(-c4cccc5sc6ccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)cc6c45)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cccc5sc6ccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)cc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)nc(-c3cccc4sc5ccccc5c34)n2)cc1.c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5ccc(-c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5ccc(-c6cccc7c6-c6ccccc6C76c7ccccc7-c7ccccc76)cc5c34)n2)cc1.
What is the InChIKey of 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine?
The InChIKey is SOPKTGRIGNRTSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H44N4S.C57H36N4S.2C52H31N3S.C51H30N4O2.C51H30N4OS/c1-6-19-45(20-7-1)51-37-52(46-21-8-2-9-22-46)40-55(39-51)67-70-68(56-41-53(47-23-10-3-11-24-47)38-54(42-56)48-25-12-4-13-26-48)72-69(71-67)59-30-18-32-65-66(59)61-44-50(34-36-64(61)74-65)49-33-35-63-60(43-49)58-29-16-17-31-62(58)73(63)57-27-14-5-15-28-57;1-4-15-37(16-5-1)39-19-12-21-43(33-39)55-58-56(44-22-13-20-40(34-44)38-17-6-2-7-18-38)60-57(59-55)47-26-14-28-53-54(47)49-36-42(30-32-52(49)62-53)41-29-31-51-48(35-41)46-25-10-11-27-50(46)61(51)45-23-8-3-9-24-45;1-3-15-32(16-4-1)49-53-50(33-17-5-2-6-18-33)55-51(54-49)39-23-14-28-46-48(39)40-31-34(29-30-45(40)56-46)35-22-13-27-44-47(35)38-21-9-12-26-43(38)52(44)41-24-10-7-19-36(41)37-20-8-11-25-42(37)52;1-3-14-32(15-4-1)49-53-50(33-16-5-2-6-17-33)55-51(54-49)40-21-13-25-47-48(40)41-30-34(27-29-46(41)56-47)35-26-28-39-38-20-9-12-24-44(38)52(45(39)31-35)42-22-10-7-18-36(42)37-19-8-11-23-43(37)52;1-3-13-31(14-4-1)49-52-50(37-19-11-23-45-47(37)36-18-8-10-22-43(36)56-45)54-51(53-49)38-20-12-24-46-48(38)40-30-33(26-28-44(40)57-46)32-25-27-42-39(29-32)35-17-7-9-21-41(35)55(42)34-15-5-2-6-16-34;1-3-13-31(14-4-1)49-52-50(54-51(53-49)38-20-12-24-46-48(38)36-18-8-10-23-45(36)57-46)37-19-11-22-44-47(37)40-30-33(26-28-43(40)56-44)32-25-27-42-39(29-32)35-17-7-9-21-41(35)55(42)34-15-5-2-6-16-34/h1-44H;1-36H;2*1-31H;2*1-30H.
What are the key properties of 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine?
3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine has a molecular weight of 4707.75 g/mol, XLogP of 87.85, 34 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenylcarbazole;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[8-(9,9'-spirobi[fluorene]-4'-yl)dibenzothiophen-1-yl]-1,3,5-triazine is sourced from PubChem (CID 160893778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).