[3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane

C226H167N13Si4 — CID 157158375

IUPAC[3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane
SMILESCc1ccccc1-c1nc(-c2cccc(C(c3ccccc3)(c3ccccc3)c3ccccc3)c2)nc(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)n1.c1ccc(-c2nc(-c3cccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)nc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)n2)cc1
InChIInChI=1S/C59H45N3Si.C59H43N3.C57H43N3Si2.C51H36N4Si/c1-44-24-20-21-41-55(44)58-61-56(45-25-22-33-50(42-45)59(47-27-8-2-9-28-47,48-29-10-3-11-30-48)49-31-12-4-13-32-49)60-57(62-58)46-26-23-40-54(43-46)63(51-34-14-5-15-35-51,52-36-16-6-17-37-52)53-38-18-7-19-39-53;1-8-24-44(25-9-1)55-60-56(45-26-22-40-53(42-45)58(47-28-10-2-11-29-47,48-30-12-3-13-31-48)49-32-14-4-15-33-49)62-57(61-55)46-27-23-41-54(43-46)59(50-34-16-5-17-35-50,51-36-18-6-19-37-51)52-38-20-7-21-39-52;1-8-24-44(25-9-1)55-58-56(45-26-22-40-53(42-45)61(47-28-10-2-11-29-47,48-30-12-3-13-31-48)49-32-14-4-15-33-49)60-57(59-55)46-27-23-41-54(43-46)62(50-34-16-5-17-35-50,51-36-18-6-19-37-51)52-38-20-7-21-39-52;1-6-19-37(20-7-1)49-52-50(54-51(53-49)39-33-34-48-46(36-39)45-31-16-17-32-47(45)55(48)40-22-8-2-9-23-40)38-21-18-30-44(35-38)56(41-24-10-3-11-25-41,42-26-12-4-13-27-42)43-28-14-5-15-29-43/h2-43H,1H3;2*1-43H;1-36H
InChIKeyAMBRGNRSKSHARE-UHFFFAOYSA-N
MW3177.26 g/mol
LogP41.55
Rot. Bonds41

About [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane

[3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane (PubChem CID 157158375) has the molecular formula C226H167N13Si4 and a molecular weight of 3177.26 g/mol. Its IUPAC name is [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane.

Molecular Properties

Compound Name[3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane
PubChem CID157158375
Molecular FormulaC226H167N13Si4
Molecular Weight3177.26 g/mol
Exact Mass3174.25
IUPAC Name[3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane
SMILESCc1ccccc1-c1nc(-c2cccc(C(c3ccccc3)(c3ccccc3)c3ccccc3)c2)nc(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)n1.c1ccc(-c2nc(-c3cccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)nc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)n2)cc1
InChIInChI=1S/C59H45N3Si.C59H43N3.C57H43N3Si2.C51H36N4Si/c1-44-24-20-21-41-55(44)58-61-56(45-25-22-33-50(42-45)59(47-27-8-2-9-28-47,48-29-10-3-11-30-48)49-31-12-4-13-32-49)60-57(62-58)46-26-23-40-54(43-46)63(51-34-14-5-15-35-51,52-36-16-6-17-37-52)53-38-18-7-19-39-53;1-8-24-44(25-9-1)55-60-56(45-26-22-40-53(42-45)58(47-28-10-2-11-29-47,48-30-12-3-13-31-48)49-32-14-4-15-33-49)62-57(61-55)46-27-23-41-54(43-46)59(50-34-16-5-17-35-50,51-36-18-6-19-37-51)52-38-20-7-21-39-52;1-8-24-44(25-9-1)55-58-56(45-26-22-40-53(42-45)61(47-28-10-2-11-29-47,48-30-12-3-13-31-48)49-32-14-4-15-33-49)60-57(59-55)46-27-23-41-54(43-46)62(50-34-16-5-17-35-50,51-36-18-6-19-37-51)52-38-20-7-21-39-52;1-6-19-37(20-7-1)49-52-50(54-51(53-49)39-33-34-48-46(36-39)45-31-16-17-32-47(45)55(48)40-22-8-2-9-23-40)38-21-18-30-44(35-38)56(41-24-10-3-11-25-41,42-26-12-4-13-27-42)43-28-14-5-15-29-43/h2-43H,1H3;2*1-43H;1-36H
InChIKeyAMBRGNRSKSHARE-UHFFFAOYSA-N
XLogP41.55
TPSA159.61 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds41
Heavy Atoms243
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003177.26
LogP ≤ 541.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane with MolForge

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Related Compounds

[3-[4-(2-methylphenyl)-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]silane
CID 163720378
2-(2-methylphenyl)-4,6-bis(3-tritylphenyl)-1,3,5-triazine;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[3-(1,2,3,4-tetradeuteriocarbazol-9-yl)carbazol-9-yl]phenyl]silane
CID 165065810
2-(2,6-dimethylphenyl)-4,6-bis(3-tritylphenyl)-1,3,5-triazine;2-(2-methylphenyl)-4,6-bis(3-tritylphenyl)-1,3,5-triazine;[3-[4-(2-methylphenyl)-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane
CID 158046527
[3-[4-carbazol-9-yl-6-(2,6-dimethylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;[3-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 165053274
[3-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;methane
CID 158156275
9-phenyl-3-[6-phenyl-2-(3-tritylphenyl)pyrimidin-4-yl]carbazole
CID 162701565
3-[4-naphthalen-1-yl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 167378833
[3-[4-(3-carbazol-9-ylcarbazol-9-yl)-6-(4-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane
CID 169281943
3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-methylphenyl]-9-phenylcarbazole
CID 122224307
tris(3-phenylphenyl)-[3-[4-phenyl-6-(3-phenylcarbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]silane
CID 168836420
[3-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]phenyl]-triphenylsilane
CID 90773884
[3-[4-carbazol-9-yl-6-[2-[4-carbazol-9-yl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-triphenylsilane
CID 157212268

Frequently Asked Questions

What is the IUPAC name of [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane?
The IUPAC name of [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane (CID 157158375) is [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane.
What is the SMILES notation for [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane?
The canonical SMILES for [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane is Cc1ccccc1-c1nc(-c2cccc(C(c3ccccc3)(c3ccccc3)c3ccccc3)c2)nc(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)n1.c1ccc(-c2nc(-c3cccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)nc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)n2)cc1.
What is the InChIKey of [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane?
The InChIKey is AMBRGNRSKSHARE-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H45N3Si.C59H43N3.C57H43N3Si2.C51H36N4Si/c1-44-24-20-21-41-55(44)58-61-56(45-25-22-33-50(42-45)59(47-27-8-2-9-28-47,48-29-10-3-11-30-48)49-31-12-4-13-32-49)60-57(62-58)46-26-23-40-54(43-46)63(51-34-14-5-15-35-51,52-36-16-6-17-37-52)53-38-18-7-19-39-53;1-8-24-44(25-9-1)55-60-56(45-26-22-40-53(42-45)58(47-28-10-2-11-29-47,48-30-12-3-13-31-48)49-32-14-4-15-33-49)62-57(61-55)46-27-23-41-54(43-46)59(50-34-16-5-17-35-50,51-36-18-6-19-37-51)52-38-20-7-21-39-52;1-8-24-44(25-9-1)55-58-56(45-26-22-40-53(42-45)61(47-28-10-2-11-29-47,48-30-12-3-13-31-48)49-32-14-4-15-33-49)60-57(59-55)46-27-23-41-54(43-46)62(50-34-16-5-17-35-50,51-36-18-6-19-37-51)52-38-20-7-21-39-52;1-6-19-37(20-7-1)49-52-50(54-51(53-49)39-33-34-48-46(36-39)45-31-16-17-32-47(45)55(48)40-22-8-2-9-23-40)38-21-18-30-44(35-38)56(41-24-10-3-11-25-41,42-26-12-4-13-27-42)43-28-14-5-15-29-43/h2-43H,1H3;2*1-43H;1-36H.
What are the key properties of [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane?
[3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane has a molecular weight of 3177.26 g/mol, XLogP of 41.55, 41 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[4-(2-methylphenyl)-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane;2-phenyl-4,6-bis(3-tritylphenyl)-1,3,5-triazine;triphenyl-[3-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]silane;triphenyl-[3-[4-phenyl-6-(3-triphenylsilylphenyl)-1,3,5-triazin-2-yl]phenyl]silane is sourced from PubChem (CID 157158375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).