2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine

C475H340ClF4N39OS3 — CID 165000270

About 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine

2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine (PubChem CID 165000270) has the molecular formula C475H340ClF4N39OS3 and a molecular weight of 6817.86 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine.

Molecular Properties

• Compound Name: 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine
• PubChem CID: 165000270
• Molecular Formula: C475H340ClF4N39OS3
• Molecular Weight: 6817.86 g/mol
• Exact Mass: 6811.65
• IUPAC Name: 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine
• SMILES: CC1(C)c2ccccc2-c2cc(-c3nc(-c4cc(-c5ccc6c(c5)C5(c7ccccc7-6)C6CC7CC(C6)CC5C7)cc(-c5nc(-c6ccccc6)nc(-c6cccc7ccccc67)n5)c4)nc(-c4ccc5ccccc5c4)n3)ccc21.CCc1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccc(C(C)C)cc5)n4)c(-c4ccc5c(c4)-c4c(-c6cccc7c6-c6ccccc6C7(C)C)cccc4C54C5CC6CC(C5)CC4C6)cc3F)n2)cc1.[C-]#[N+]c1ccc(-c2nc(-c3ccc(Cl)cc3)nc(-c3ccc4c(sc5cccc(-c6nc(-c7ccccc7)nc(-c7ccc(C(F)(F)F)cc7)n6)c54)c3-c3ccc4c(c3)C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)n2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccc6c(c5)C5(c7ccccc7-6)C6CC7CC(C6)CC5C7)cc(-c5nc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)nc(-c6cccc(-c7ccc8c(c7)oc7ccccc78)c6)n5)c4)n3)c(-c3ccccc3)c2)cc1.c1ccc(-c2nc(-c3cc(-c4ccc5c(c4)C4(c6ccccc6-5)C5CC6CC(C5)CC4C6)cc(-c4nc(-c5ccc6ccccc6c5)nc(-c5ccc6sc7ccccc7c6c5)n4)c3)nc(-c3cccc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3cc(-c4ccc5c(c4)C4(c6ccccc6-5)C5CC6CC(C5)CC4C6)cc(-c4nc(-c5cccc(-c6ccc7c(c6)sc6ccccc67)c5)nc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)n4)c3)nc(-c3cc4ccccc4c4ccccc34)n2)cc1
• InChI: InChI=1S/C94H65N7O.C90H61N7S.C78H65FN6.C75H56N6.C72H50N6S.C66H43ClF3N7S/c1-4-19-59(20-5-1)64-39-44-80(81(54-64)60-21-6-2-7-22-60)93-99-88(61-23-8-3-9-24-61)96-92(100-93)70-52-68(65-37-42-75-74-27-10-14-31-82(74)94(83(75)55-65)71-46-57-45-58(48-71)49-72(94)47-57)51-69(53-70)91-97-89(62-35-40-73(41-36-62)101-84-32-15-11-28-76(84)77-29-12-16-33-85(77)101)95-90(98-91)67-26-18-25-63(50-67)66-38-43-79-78-30-13-17-34-86(78)102-87(79)56-66;1-3-18-55(19-4-1)84-91-88(96-89(95-84)77-49-59-20-7-8-25-68(59)69-26-9-10-27-70(69)77)64-47-62(57-34-37-72-71-28-11-14-31-78(71)90(79(72)51-57)65-41-53-40-54(43-65)44-66(90)42-53)46-63(48-64)87-93-85(60-22-17-21-56(45-60)58-35-38-75-74-30-13-16-33-82(74)98-83(75)52-58)92-86(94-87)61-36-39-81-76(50-61)73-29-12-15-32-80(73)97(81)67-23-5-2-6-24-67;1-6-46-27-29-52(30-28-46)73-81-72(51-19-11-8-12-20-51)84-76(85-73)63-43-61(75-82-71(50-17-9-7-10-18-50)80-74(83-75)53-33-31-49(32-34-53)45(2)3)60(44-68(63)79)54-35-36-65-62(42-54)70-58(57-22-15-25-66-69(57)59-21-13-14-24-64(59)77(66,4)5)23-16-26-67(70)78(65)55-38-47-37-48(40-55)41-56(78)39-47;1-74(2)64-25-12-10-23-60(64)63-42-52(30-32-65(63)74)70-77-69(51-28-27-46-15-6-7-19-49(46)38-51)78-71(79-70)54-39-53(50-29-31-61-59-22-11-13-26-66(59)75(67(61)43-50)56-34-44-33-45(36-56)37-57(75)35-44)40-55(41-54)72-76-68(48-17-4-3-5-18-48)80-73(81-72)62-24-14-20-47-16-8-9-21-58(47)62;1-2-15-46(16-3-1)66-73-70(78-71(77-66)60-22-12-18-45-14-6-7-19-56(45)60)53-38-51(48-27-29-58-57-20-8-10-23-62(57)72(63(58)41-48)54-32-42-31-43(34-54)35-55(72)33-42)37-52(39-53)69-75-67(49-26-25-44-13-4-5-17-47(44)36-49)74-68(76-69)50-28-30-65-61(40-50)59-21-9-11-24-64(59)79-65;1-71-47-25-18-41(19-26-47)62-73-61(40-16-23-46(67)24-17-40)76-64(77-62)52-29-28-50-57-51(63-74-59(38-8-3-2-4-9-38)72-60(75-63)39-14-21-43(22-15-39)66(68,69)70)11-7-13-55(57)78-58(50)56(52)42-20-27-49-48-10-5-6-12-53(48)65(54(49)35-42)44-31-36-30-37(33-44)34-45(65)32-36/h1-44,50-58,71-72H,45-49H2;1-39,45-54,65-66H,40-44H2;7-36,42-45,47-48,55-56H,6,37-41H2,1-5H3;3-32,38-45,56-57H,33-37H2,1-2H3;1-30,36-43,54-55H,31-35H2;2-29,35-37,44-45H,30-34H2
• InChIKey: IDPUNCHROZXGHP-UHFFFAOYSA-N
• XLogP: 119.80
• TPSA: 491.40 Ų
• H-Bond Acceptors: 42
• Rotatable Bonds: 51
• Heavy Atoms: 523
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	6817.86
LogP ≤ 5	119.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	42

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine?

The IUPAC name of 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine (CID 165000270) is 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine.

What is the SMILES notation for 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine?

The canonical SMILES for 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine is CC1(C)c2ccccc2-c2cc(-c3nc(-c4cc(-c5ccc6c(c5)C5(c7ccccc7-6)C6CC7CC(C6)CC5C7)cc(-c5nc(-c6ccccc6)nc(-c6cccc7ccccc67)n5)c4)nc(-c4ccc5ccccc5c4)n3)ccc21.CCc1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccc(C(C)C)cc5)n4)c(-c4ccc5c(c4)-c4c(-c6cccc7c6-c6ccccc6C7(C)C)cccc4C54C5CC6CC(C5)CC4C6)cc3F)n2)cc1.[C-]#[N+]c1ccc(-c2nc(-c3ccc(Cl)cc3)nc(-c3ccc4c(sc5cccc(-c6nc(-c7ccccc7)nc(-c7ccc(C(F)(F)F)cc7)n6)c54)c3-c3ccc4c(c3)C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)n2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccc6c(c5)C5(c7ccccc7-6)C6CC7CC(C6)CC5C7)cc(-c5nc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)nc(-c6cccc(-c7ccc8c(c7)oc7ccccc78)c6)n5)c4)n3)c(-c3ccccc3)c2)cc1.c1ccc(-c2nc(-c3cc(-c4ccc5c(c4)C4(c6ccccc6-5)C5CC6CC(C5)CC4C6)cc(-c4nc(-c5ccc6ccccc6c5)nc(-c5ccc6sc7ccccc7c6c5)n4)c3)nc(-c3cccc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3cc(-c4ccc5c(c4)C4(c6ccccc6-5)C5CC6CC(C5)CC4C6)cc(-c4nc(-c5cccc(-c6ccc7c(c6)sc6ccccc67)c5)nc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)n4)c3)nc(-c3cc4ccccc4c4ccccc34)n2)cc1.

What is the InChIKey of 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine?

The InChIKey is IDPUNCHROZXGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C94H65N7O.C90H61N7S.C78H65FN6.C75H56N6.C72H50N6S.C66H43ClF3N7S/c1-4-19-59(20-5-1)64-39-44-80(81(54-64)60-21-6-2-7-22-60)93-99-88(61-23-8-3-9-24-61)96-92(100-93)70-52-68(65-37-42-75-74-27-10-14-31-82(74)94(83(75)55-65)71-46-57-45-58(48-71)49-72(94)47-57)51-69(53-70)91-97-89(62-35-40-73(41-36-62)101-84-32-15-11-28-76(84)77-29-12-16-33-85(77)101)95-90(98-91)67-26-18-25-63(50-67)66-38-43-79-78-30-13-17-34-86(78)102-87(79)56-66;1-3-18-55(19-4-1)84-91-88(96-89(95-84)77-49-59-20-7-8-25-68(59)69-26-9-10-27-70(69)77)64-47-62(57-34-37-72-71-28-11-14-31-78(71)90(79(72)51-57)65-41-53-40-54(43-65)44-66(90)42-53)46-63(48-64)87-93-85(60-22-17-21-56(45-60)58-35-38-75-74-30-13-16-33-82(74)98-83(75)52-58)92-86(94-87)61-36-39-81-76(50-61)73-29-12-15-32-80(73)97(81)67-23-5-2-6-24-67;1-6-46-27-29-52(30-28-46)73-81-72(51-19-11-8-12-20-51)84-76(85-73)63-43-61(75-82-71(50-17-9-7-10-18-50)80-74(83-75)53-33-31-49(32-34-53)45(2)3)60(44-68(63)79)54-35-36-65-62(42-54)70-58(57-22-15-25-66-69(57)59-21-13-14-24-64(59)77(66,4)5)23-16-26-67(70)78(65)55-38-47-37-48(40-55)41-56(78)39-47;1-74(2)64-25-12-10-23-60(64)63-42-52(30-32-65(63)74)70-77-69(51-28-27-46-15-6-7-19-49(46)38-51)78-71(79-70)54-39-53(50-29-31-61-59-22-11-13-26-66(59)75(67(61)43-50)56-34-44-33-45(36-56)37-57(75)35-44)40-55(41-54)72-76-68(48-17-4-3-5-18-48)80-73(81-72)62-24-14-20-47-16-8-9-21-58(47)62;1-2-15-46(16-3-1)66-73-70(78-71(77-66)60-22-12-18-45-14-6-7-19-56(45)60)53-38-51(48-27-29-58-57-20-8-10-23-62(57)72(63(58)41-48)54-32-42-31-43(34-54)35-55(72)33-42)37-52(39-53)69-75-67(49-26-25-44-13-4-5-17-47(44)36-49)74-68(76-69)50-28-30-65-61(40-50)59-21-9-11-24-64(59)79-65;1-71-47-25-18-41(19-26-47)62-73-61(40-16-23-46(67)24-17-40)76-64(77-62)52-29-28-50-57-51(63-74-59(38-8-3-2-4-9-38)72-60(75-63)39-14-21-43(22-15-39)66(68,69)70)11-7-13-55(57)78-58(50)56(52)42-20-27-49-48-10-5-6-12-53(48)65(54(49)35-42)44-31-36-30-37(33-44)34-45(65)32-36/h1-44,50-58,71-72H,45-49H2;1-39,45-54,65-66H,40-44H2;7-36,42-45,47-48,55-56H,6,37-41H2,1-5H3;3-32,38-45,56-57H,33-37H2,1-2H3;1-30,36-43,54-55H,31-35H2;2-29,35-37,44-45H,30-34H2.

What are the key properties of 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine?

2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine has a molecular weight of 6817.86 g/mol, XLogP of 119.80, 51 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-chlorophenyl)-4-(4-isocyanophenyl)-6-[9-[4-phenyl-6-[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-4-spiro[adamantane-2,9'-fluorene]-2'-yldibenzothiophen-3-yl]-1,3,5-triazine;9-[4-[4-(3-dibenzofuran-3-ylphenyl)-6-[3-[4-(2,4-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-2-yl-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;3-[4-(3-dibenzothiophen-3-ylphenyl)-6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethylfluoren-3-yl)-4-naphthalen-2-yl-6-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl]-1,3,5-triazine;2-[2-[5'-(9,9-dimethylfluoren-4-yl)spiro[adamantane-2,9'-fluorene]-3'-yl]-5-[4-(4-ethylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorophenyl]-4-phenyl-6-(4-propan-2-ylphenyl)-1,3,5-triazine is sourced from PubChem (CID 165000270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).