triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane

C60H42N2Si — CID 171458587

IUPACtriphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane
SMILESc1ccc(-c2ccccc2-n2c3ccc(-n4c5ccccc5c5c([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cccc54)cc3c3c(-c4ccccc4)cccc32)cc1
InChIInChI=1S/C60H42N2Si/c1-6-22-43(23-7-1)49-32-16-18-35-53(49)62-55-41-40-45(42-52(55)59-50(34-20-37-56(59)62)44-24-8-2-9-25-44)61-54-36-19-17-33-51(54)60-57(61)38-21-39-58(60)63(46-26-10-3-11-27-46,47-28-12-4-13-29-47)48-30-14-5-15-31-48/h1-42H
InChIKeyUQCBJLYFWDPLSJ-UHFFFAOYSA-N
MW819.10 g/mol
LogP12.59
Rot. Bonds8

About triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane

triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane (PubChem CID 171458587) has the molecular formula C60H42N2Si and a molecular weight of 819.10 g/mol. Its IUPAC name is triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane.

Molecular Properties

Compound Nametriphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane
PubChem CID171458587
Molecular FormulaC60H42N2Si
Molecular Weight819.10 g/mol
Exact Mass818.31
IUPAC Nametriphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane
SMILESc1ccc(-c2ccccc2-n2c3ccc(-n4c5ccccc5c5c([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cccc54)cc3c3c(-c4ccccc4)cccc32)cc1
InChIInChI=1S/C60H42N2Si/c1-6-22-43(23-7-1)49-32-16-18-35-53(49)62-55-41-40-45(42-52(55)59-50(34-20-37-56(59)62)44-24-8-2-9-25-44)61-54-36-19-17-33-51(54)60-57(61)38-21-39-58(60)63(46-26-10-3-11-27-46,47-28-12-4-13-29-47)48-30-14-5-15-31-48/h1-42H
InChIKeyUQCBJLYFWDPLSJ-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-[6-(4-phenylcarbazol-9-yl)-9-(4-phenylphenyl)carbazol-4-yl]silane
CID 171457929
triphenyl-[9-[5-phenyl-9-(3-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane
CID 171458608
[9-[5-carbazol-9-yl-9-(2-phenylphenyl)carbazol-2-yl]carbazol-4-yl]-triphenylsilane
CID 170516363
diphenyl-(3-phenylphenyl)-[9-[9-(2-phenylphenyl)carbazol-2-yl]carbazol-4-yl]silane
CID 171458387
triphenyl-[9-[8-phenyl-9-(2-phenylphenyl)carbazol-2-yl]carbazol-4-yl]silane
CID 170515756
[9-(5,9-diphenylcarbazol-4-yl)carbazol-4-yl]-triphenylsilane
CID 170516212
[6-carbazol-9-yl-9-(4-phenylphenyl)carbazol-4-yl]-triphenylsilane
CID 171458247
[6-carbazol-9-yl-9-[9-(2-phenylphenyl)carbazol-3-yl]carbazol-1-yl]-triphenylsilane
CID 170515996
(3-carbazol-9-ylphenyl)-[3-(3-carbazol-9-yl-5-phenylcarbazol-9-yl)phenyl]-diphenylsilane
CID 171457919
diphenyl-(3-phenylphenyl)-[3-[5-phenyl-3-(4-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]silane
CID 171458498
[9-[9-(2,5-diphenylphenyl)carbazol-2-yl]carbazol-4-yl]-triphenylsilane
CID 170516404
triphenyl-[8-phenyl-9-(9-phenylcarbazol-4-yl)carbazol-4-yl]silane
CID 170516087

Frequently Asked Questions

What is the IUPAC name of triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane?
The IUPAC name of triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane (CID 171458587) is triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane.
What is the SMILES notation for triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane?
The canonical SMILES for triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane is c1ccc(-c2ccccc2-n2c3ccc(-n4c5ccccc5c5c([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cccc54)cc3c3c(-c4ccccc4)cccc32)cc1.
What is the InChIKey of triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane?
The InChIKey is UQCBJLYFWDPLSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H42N2Si/c1-6-22-43(23-7-1)49-32-16-18-35-53(49)62-55-41-40-45(42-52(55)59-50(34-20-37-56(59)62)44-24-8-2-9-25-44)61-54-36-19-17-33-51(54)60-57(61)38-21-39-58(60)63(46-26-10-3-11-27-46,47-28-12-4-13-29-47)48-30-14-5-15-31-48/h1-42H.
What are the key properties of triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane?
triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-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-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane is sourced from PubChem (CID 171458587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).