triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane

C66H45N3Si — CID 166588416

IUPACtriphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c6ccccc6n(-c6ccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cc6)c45)c3c2)cc1
InChIInChI=1S/C66H45N3Si/c1-5-20-46(21-6-1)47-36-42-57-54-28-13-16-32-60(54)67(65(57)44-47)49-39-43-63-59(45-49)56-30-15-18-34-62(56)69(63)64-35-19-31-58-55-29-14-17-33-61(55)68(66(58)64)48-37-40-53(41-38-48)70(50-22-7-2-8-23-50,51-24-9-3-10-25-51)52-26-11-4-12-27-52/h1-45H
InChIKeyYTDDBKRXFFDMCW-UHFFFAOYSA-N
MW908.19 g/mol
LogP14.02
Rot. Bonds8

About triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane

triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane (PubChem CID 166588416) has the molecular formula C66H45N3Si and a molecular weight of 908.19 g/mol. Its IUPAC name is triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane.

Molecular Properties

Compound Nametriphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
PubChem CID166588416
Molecular FormulaC66H45N3Si
Molecular Weight908.19 g/mol
Exact Mass907.34
IUPAC Nametriphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c6ccccc6n(-c6ccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cc6)c45)c3c2)cc1
InChIInChI=1S/C66H45N3Si/c1-5-20-46(21-6-1)47-36-42-57-54-28-13-16-32-60(54)67(65(57)44-47)49-39-43-63-59(45-49)56-30-15-18-34-62(56)69(63)64-35-19-31-58-55-29-14-17-33-61(55)68(66(58)64)48-37-40-53(41-38-48)70(50-22-7-2-8-23-50,51-24-9-3-10-25-51)52-26-11-4-12-27-52/h1-45H
InChIKeyYTDDBKRXFFDMCW-UHFFFAOYSA-N
XLogP14.02
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500908.19
LogP ≤ 514.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

triphenyl-[4-[2-[1-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588219
triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-2-yl]silane
CID 170515983
[8-carbazol-9-yl-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-triphenylsilane
CID 170516287
triphenyl-[6-(2-phenylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 170516502
triphenyl-[4-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588633
triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane
CID 170515471
[7-carbazol-9-yl-9-(9-phenylcarbazol-1-yl)carbazol-2-yl]-triphenylsilane
CID 170515020
triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
CID 170515813
[8-carbazol-9-yl-9-(9-phenylcarbazol-2-yl)carbazol-2-yl]-triphenylsilane
CID 170516283
triphenyl-[3-[3-[1-(3-triphenylsilylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588869
[3-[3-(5-carbazol-9-yl-2-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 166588896
triphenyl-[3-[3-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588203

Frequently Asked Questions

What is the IUPAC name of triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane?
The IUPAC name of triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane (CID 166588416) is triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane.
What is the SMILES notation for triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane?
The canonical SMILES for triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane is c1ccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c6ccccc6n(-c6ccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cc6)c45)c3c2)cc1.
What is the InChIKey of triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane?
The InChIKey is YTDDBKRXFFDMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H45N3Si/c1-5-20-46(21-6-1)47-36-42-57-54-28-13-16-32-60(54)67(65(57)44-47)49-39-43-63-59(45-49)56-30-15-18-34-62(56)69(63)64-35-19-31-58-55-29-14-17-33-61(55)68(66(58)64)48-37-40-53(41-38-48)70(50-22-7-2-8-23-50,51-24-9-3-10-25-51)52-26-11-4-12-27-52/h1-45H.
What are the key properties of triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane?
triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane has a molecular weight of 908.19 g/mol, XLogP of 14.02, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane is sourced from PubChem (CID 166588416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).