triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane

C60H42N2Si — CID 170515100

IUPACtriphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cccc(-n5c6cc(-c7ccccc7)ccc6c6c([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cccc65)c43)cc2)cc1
InChIInChI=1S/C60H42N2Si/c1-6-20-43(21-7-1)45-36-39-47(40-37-45)61-54-32-17-16-30-51(54)52-31-18-34-56(60(52)61)62-55-33-19-35-58(59(55)53-41-38-46(42-57(53)62)44-22-8-2-9-23-44)63(48-24-10-3-11-25-48,49-26-12-4-13-27-49)50-28-14-5-15-29-50/h1-42H
InChIKeyLRUYGYLUKSNZQQ-UHFFFAOYSA-N
MW819.10 g/mol
LogP12.59
Rot. Bonds8

About triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane

triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane (PubChem CID 170515100) has the molecular formula C60H42N2Si and a molecular weight of 819.10 g/mol. Its IUPAC name is triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane.

Molecular Properties

Compound Nametriphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane
PubChem CID170515100
Molecular FormulaC60H42N2Si
Molecular Weight819.10 g/mol
Exact Mass818.31
IUPAC Nametriphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cccc(-n5c6cc(-c7ccccc7)ccc6c6c([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cccc65)c43)cc2)cc1
InChIInChI=1S/C60H42N2Si/c1-6-20-43(21-7-1)45-36-39-47(40-37-45)61-54-32-17-16-30-51(54)52-31-18-34-56(60(52)61)62-55-33-19-35-58(59(55)53-41-38-46(42-57(53)62)44-22-8-2-9-23-44)63(48-24-10-3-11-25-48,49-26-12-4-13-27-49)50-28-14-5-15-29-50/h1-42H
InChIKeyLRUYGYLUKSNZQQ-UHFFFAOYSA-N
XLogP12.59
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500819.10
LogP ≤ 512.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[9-[7-phenyl-9-(3-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane
CID 170516222
[9-[8-carbazol-9-yl-9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]-triphenylsilane
CID 170515914
[8-carbazol-9-yl-9-[9-(4-phenylphenyl)carbazol-2-yl]carbazol-4-yl]-triphenylsilane
CID 170516471
triphenyl-[7-phenyl-9-(9-phenylcarbazol-1-yl)carbazol-1-yl]silane
CID 170515238
diphenyl-(9-phenylcarbazol-3-yl)-[9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane
CID 171458283
triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-2-yl]silane
CID 170515983
triphenyl-[4-[2-[1-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588219
[9-[9-(2,5-diphenylphenyl)carbazol-2-yl]carbazol-4-yl]-triphenylsilane
CID 170516404
triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588416
diphenyl-(3-phenylphenyl)-[9-[9-(2-phenylphenyl)carbazol-2-yl]carbazol-4-yl]silane
CID 171458387
[9-(5-carbazol-9-yl-9-phenylcarbazol-1-yl)carbazol-4-yl]-triphenylsilane
CID 170515290
triphenyl-[8-phenyl-9-[9-(4-phenylphenyl)carbazol-2-yl]carbazol-4-yl]silane
CID 170516013

Frequently Asked Questions

What is the IUPAC name of triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane?
The IUPAC name of triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane (CID 170515100) is triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane.
What is the SMILES notation for triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane?
The canonical SMILES for triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane is c1ccc(-c2ccc(-n3c4ccccc4c4cccc(-n5c6cc(-c7ccccc7)ccc6c6c([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cccc65)c43)cc2)cc1.
What is the InChIKey of triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane?
The InChIKey is LRUYGYLUKSNZQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H42N2Si/c1-6-20-43(21-7-1)45-36-39-47(40-37-45)61-54-32-17-16-30-51(54)52-31-18-34-56(60(52)61)62-55-33-19-35-58(59(55)53-41-38-46(42-57(53)62)44-22-8-2-9-23-44)63(48-24-10-3-11-25-48,49-26-12-4-13-27-49)50-28-14-5-15-29-50/h1-42H.
What are the key properties of triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane?
triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane has a molecular weight of 819.10 g/mol, XLogP of 12.59, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-4-yl]silane is sourced from PubChem (CID 170515100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).