2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline

C221H143F3N26O4Si — CID 161205146

IUPAC2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline
SMILESC1=C(c2cccc(-c3ccccn3)n2)[Si]2(C(c3cccc(-c4ccccn4)n3)=C1)C(c1cccc(-c3ccccn3)n1)=CC=C2c1cccc(-c2ccccn2)n1.CC(C)(c1ccc(Oc2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1)c1ccc(Oc2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1.CC(c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1)(c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1)C(F)(F)F.c1cnc2c(c1)ccc1ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc7ccc8cccnc8c7n6)ccc5-4)c4cc(-c5ccc6ccc7cccnc7c6n5)ccc4-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc43)nc12
InChIInChI=1S/C73H40N8.C57H42N6O2.C48H32N8Si.C43H29F3N4O2/c1-5-41-9-13-45-21-29-61(78-69(45)65(41)74-33-1)49-17-25-53-54-26-18-50(62-30-22-46-14-10-42-6-2-34-75-66(42)70(46)79-62)38-58(54)73(57(53)37-49)59-39-51(63-31-23-47-15-11-43-7-3-35-76-67(43)71(47)80-63)19-27-55(59)56-28-20-52(40-60(56)73)64-32-24-48-16-12-44-8-4-36-77-68(44)72(48)81-64;1-57(2,45-27-35-49(36-28-45)64-47-31-23-43(24-32-47)55-60-51(39-15-7-3-8-16-39)58-52(61-55)40-17-9-4-10-18-40)46-29-37-50(38-30-46)65-48-33-25-44(26-34-48)56-62-53(41-19-11-5-12-20-41)59-54(63-56)42-21-13-6-14-22-42;1-5-29-49-33(13-1)37-17-9-21-41(53-37)45-25-26-46(42-22-10-18-38(54-42)34-14-2-6-30-50-34)57(45)47(43-23-11-19-39(55-43)35-15-3-7-31-51-35)27-28-48(57)44-24-12-20-40(56-44)36-16-4-8-32-52-36;1-42(43(44,45)46,36-24-20-34(21-25-36)40-49-47-38(51-40)32-16-12-30(13-17-32)28-8-4-2-5-9-28)37-26-22-35(23-27-37)41-50-48-39(52-41)33-18-14-31(15-19-33)29-10-6-3-7-11-29/h1-40H;3-38H,1-2H3;1-32H;2-27H,1H3
InChIKeyUVMOTRYBYBDKRV-UHFFFAOYSA-N
MW3311.83 g/mol
LogP52.16
Rot. Bonds32

About 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline

2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline (PubChem CID 161205146) has the molecular formula C221H143F3N26O4Si and a molecular weight of 3311.83 g/mol. Its IUPAC name is 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline.

Molecular Properties

Compound Name2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline
PubChem CID161205146
Molecular FormulaC221H143F3N26O4Si
Molecular Weight3311.83 g/mol
Exact Mass3309.15
IUPAC Name2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline
SMILESC1=C(c2cccc(-c3ccccn3)n2)[Si]2(C(c3cccc(-c4ccccn4)n3)=C1)C(c1cccc(-c3ccccn3)n1)=CC=C2c1cccc(-c2ccccn2)n1.CC(C)(c1ccc(Oc2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1)c1ccc(Oc2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1.CC(c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1)(c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1)C(F)(F)F.c1cnc2c(c1)ccc1ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc7ccc8cccnc8c7n6)ccc5-4)c4cc(-c5ccc6ccc7cccnc7c6n5)ccc4-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc43)nc12
InChIInChI=1S/C73H40N8.C57H42N6O2.C48H32N8Si.C43H29F3N4O2/c1-5-41-9-13-45-21-29-61(78-69(45)65(41)74-33-1)49-17-25-53-54-26-18-50(62-30-22-46-14-10-42-6-2-34-75-66(42)70(46)79-62)38-58(54)73(57(53)37-49)59-39-51(63-31-23-47-15-11-43-7-3-35-76-67(43)71(47)80-63)19-27-55(59)56-28-20-52(40-60(56)73)64-32-24-48-16-12-44-8-4-36-77-68(44)72(48)81-64;1-57(2,45-27-35-49(36-28-45)64-47-31-23-43(24-32-47)55-60-51(39-15-7-3-8-16-39)58-52(61-55)40-17-9-4-10-18-40)46-29-37-50(38-30-46)65-48-33-25-44(26-34-48)56-62-53(41-19-11-5-12-20-41)59-54(63-56)42-21-13-6-14-22-42;1-5-29-49-33(13-1)37-17-9-21-41(53-37)45-25-26-46(42-22-10-18-38(54-42)34-14-2-6-30-50-34)57(45)47(43-23-11-19-39(55-43)35-15-3-7-31-51-35)27-28-48(57)44-24-12-20-40(56-44)36-16-4-8-32-52-36;1-42(43(44,45)46,36-24-20-34(21-25-36)40-49-47-38(51-40)32-16-12-30(13-17-32)28-8-4-2-5-9-28)37-26-22-35(23-27-37)41-50-48-39(52-41)33-18-14-31(15-19-33)29-10-6-3-7-11-29/h1-40H;3-38H,1-2H3;1-32H;2-27H,1H3
InChIKeyUVMOTRYBYBDKRV-UHFFFAOYSA-N
XLogP52.16
TPSA379.88 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds32
Heavy Atoms255
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003311.83
LogP ≤ 552.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

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

Analyze 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline with MolForge

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Related Compounds

2,7-Bis(4-hexylphenyl)-4,9-diphenylpyrido[2,3-g]quinoline;2-[3,5-bis[3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]phenyl]-6-methyl-3-phenylquinoxaline;2-(4-tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 157267013
2-[3,5-Bis[3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]phenyl]-6-methyl-3-phenylquinoxaline;2-(4-tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;7-(4-hexylphenyl)-2-(4-pentylphenyl)-4,9-diphenylpyrido[2,3-g]quinoline
CID 157509894
2-(4-Tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline
CID 157803321
2,7-Bis(4-hexylphenyl)-4,9-diphenylpyrido[2,3-g]quinoline;2-[3,5-bis(1-phenylbenzimidazol-2-yl)phenyl]-1-phenylbenzimidazole;2-[3,5-bis[3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]phenyl]-6-methyl-3-phenylquinoxaline;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 157826536
2-[3,5-Bis[3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]phenyl]-6-methyl-3-phenylquinoxaline;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 158072566
2-(4-tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-5-[4-[(3E)-hexa-1,3,5-trien-3-yl]phenyl]-4-phenyl-1,2,4-triazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-[1,1-dimethyl-3,4-diphenyl-5-(6-phenyl-2-pyridinyl)silol-2-yl]-6-pyridin-2-ylpyridine;1,1-dimethyl-2,3,4,5-tetraphenylsilole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3-methylphenyl)-5-[4-[tris[4-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methyl]phenyl]-1,3,4-oxadiazole
CID 158093473
2-[3,5-Bis[3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]phenyl]-6-methyl-3-phenylquinoxaline;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3-methylphenyl)-5-[4-[tris[4-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methyl]phenyl]-1,3,4-oxadiazole
CID 158115436
2-[3,5-Bis[3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]phenyl]-6-methyl-3-phenylquinoxaline;2-(4-tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 158680581
2-[3,5-Bis[3-phenyl-6-(trifluoromethyl)quinoxalin-2-yl]phenyl]-6-methyl-3-phenylquinoxaline;2-(4-tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole;2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-1,1,1-trifluoropropan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3-methylphenyl)-5-[4-[tris[4-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methyl]phenyl]-1,3,4-oxadiazole
CID 159216798
2-(4-Tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;4,7-diphenyl-1,10-phenanthroline;[2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane;2-(3-methylphenyl)-5-[4-[tris[4-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methyl]phenyl]-1,3,4-oxadiazole
CID 159257931
2-(4-Tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-[5,5-dimethyl-2,3-diphenyl-4-(6-pyridin-2-yl-2-pyridinyl)cyclopenta-1,3-dien-1-yl]-6-pyridin-2-ylpyridine;(3,3-dimethyl-2,4,5-triphenylcyclopenta-1,4-dien-1-yl)benzene;4,7-diphenyl-1,10-phenanthroline;[2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane;2-(3-methylphenyl)-5-[4-[tris[4-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methyl]phenyl]-1,3,4-oxadiazole;trimethyl-[3-[10-(3-methylphenyl)-7,7-diphenyl-3,11-disilatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]phenyl]silane
CID 159325587
2-(4-Tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;2-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-2-pyridinyl)silol-2-yl]-6-pyridin-2-ylpyridine;(3,3-dimethyl-2,4,5-triphenylcyclopenta-1,4-dien-1-yl)benzene;4,7-diphenyl-1,10-phenanthroline;[2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane;2-(3-methylphenyl)-5-[4-[tris[4-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methyl]phenyl]-1,3,4-oxadiazole;trimethyl-[3-[10-(3-methylphenyl)-7,7-diphenyl-3,11-disilatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]phenyl]silane
CID 159489652

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline?
The IUPAC name of 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline (CID 161205146) is 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline.
What is the SMILES notation for 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline?
The canonical SMILES for 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline is C1=C(c2cccc(-c3ccccn3)n2)[Si]2(C(c3cccc(-c4ccccn4)n3)=C1)C(c1cccc(-c3ccccn3)n1)=CC=C2c1cccc(-c2ccccn2)n1.CC(C)(c1ccc(Oc2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1)c1ccc(Oc2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1.CC(c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1)(c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1)C(F)(F)F.c1cnc2c(c1)ccc1ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc7ccc8cccnc8c7n6)ccc5-4)c4cc(-c5ccc6ccc7cccnc7c6n5)ccc4-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc43)nc12.
What is the InChIKey of 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline?
The InChIKey is UVMOTRYBYBDKRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H40N8.C57H42N6O2.C48H32N8Si.C43H29F3N4O2/c1-5-41-9-13-45-21-29-61(78-69(45)65(41)74-33-1)49-17-25-53-54-26-18-50(62-30-22-46-14-10-42-6-2-34-75-66(42)70(46)79-62)38-58(54)73(57(53)37-49)59-39-51(63-31-23-47-15-11-43-7-3-35-76-67(43)71(47)80-63)19-27-55(59)56-28-20-52(40-60(56)73)64-32-24-48-16-12-44-8-4-36-77-68(44)72(48)81-64;1-57(2,45-27-35-49(36-28-45)64-47-31-23-43(24-32-47)55-60-51(39-15-7-3-8-16-39)58-52(61-55)40-17-9-4-10-18-40)46-29-37-50(38-30-46)65-48-33-25-44(26-34-48)56-62-53(41-19-11-5-12-20-41)59-54(63-56)42-21-13-6-14-22-42;1-5-29-49-33(13-1)37-17-9-21-41(53-37)45-25-26-46(42-22-10-18-38(54-42)34-14-2-6-30-50-34)57(45)47(43-23-11-19-39(55-43)35-15-3-7-31-51-35)27-28-48(57)44-24-12-20-40(56-44)36-16-4-8-32-52-36;1-42(43(44,45)46,36-24-20-34(21-25-36)40-49-47-38(51-40)32-16-12-30(13-17-32)28-8-4-2-5-9-28)37-26-22-35(23-27-37)41-50-48-39(52-41)33-18-14-31(15-19-33)29-10-6-3-7-11-29/h1-40H;3-38H,1-2H3;1-32H;2-27H,1H3.
What are the key properties of 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline?
2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline has a molecular weight of 3311.83 g/mol, XLogP of 52.16, 32 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-[2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-4,6-diphenyl-1,3,5-triazine;2-(4-phenylphenyl)-5-[4-[1,1,1-trifluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-1,3,4-oxadiazole;2-pyridin-2-yl-6-[1,4,9-tris(6-pyridin-2-yl-2-pyridinyl)-5-silaspiro[4.4]nona-1,3,6,8-tetraen-6-yl]pyridine;2-[2',7,7'-tris(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline is sourced from PubChem (CID 161205146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).