triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane

C60H42N2Si — CID 170515471

IUPACtriphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane
SMILESc1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5cccc(-n6c7ccccc7c7cc([Si](c8ccccc8)(c8ccccc8)c8ccccc8)ccc76)c54)c3)c2)cc1
InChIInChI=1S/C60H42N2Si/c1-5-20-43(21-6-1)44-22-17-23-45(40-44)46-24-18-25-47(41-46)61-56-35-15-13-32-52(56)54-34-19-37-59(60(54)61)62-57-36-16-14-33-53(57)55-42-51(38-39-58(55)62)63(48-26-7-2-8-27-48,49-28-9-3-10-29-49)50-30-11-4-12-31-50/h1-42H
InChIKeyVRTHWZYOFJVUFH-UHFFFAOYSA-N
MW819.10 g/mol
LogP12.59
Rot. Bonds8

About triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane

triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane (PubChem CID 170515471) has the molecular formula C60H42N2Si and a molecular weight of 819.10 g/mol. Its IUPAC name is triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane.

Molecular Properties

Compound Nametriphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane
PubChem CID170515471
Molecular FormulaC60H42N2Si
Molecular Weight819.10 g/mol
Exact Mass818.31
IUPAC Nametriphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane
SMILESc1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5cccc(-n6c7ccccc7c7cc([Si](c8ccccc8)(c8ccccc8)c8ccccc8)ccc76)c54)c3)c2)cc1
InChIInChI=1S/C60H42N2Si/c1-5-20-43(21-6-1)44-22-17-23-45(40-44)46-24-18-25-47(41-46)61-56-35-15-13-32-52(56)54-34-19-37-59(60(54)61)62-57-36-16-14-33-53(57)55-42-51(38-39-58(55)62)63(48-26-7-2-8-27-48,49-28-9-3-10-29-49)50-30-11-4-12-31-50/h1-42H
InChIKeyVRTHWZYOFJVUFH-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-[3-[3-[1-(3-triphenylsilylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588869
[8-carbazol-9-yl-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-triphenylsilane
CID 170516287
triphenyl-[3-[4-[1-(3-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588340
triphenyl-[4-[1-[3-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588416
triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-2-yl]silane
CID 170515983
[9-(5,9-diphenylcarbazol-1-yl)carbazol-3-yl]-triphenylsilane
CID 170515314
triphenyl-[9-phenyl-6-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazol-3-yl]silane
CID 140790437
triphenyl-[3-[3-[3-(9-phenylcarbazol-3-yl)-6-(3-phenylphenyl)carbazol-9-yl]phenyl]phenyl]silane
CID 166589020
[4-[3-[1-(3-cyclohexylcarbazol-9-yl)carbazol-9-yl]phenyl]phenyl]-triphenylsilane
CID 176779800
triphenyl-[4-[2-[1-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588219
triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane
CID 170515043
[9-(1,9-diphenylcarbazol-2-yl)carbazol-3-yl]-triphenylsilane
CID 170516340

Frequently Asked Questions

What is the IUPAC name of triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane?
The IUPAC name of triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane (CID 170515471) is triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane.
What is the SMILES notation for triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane?
The canonical SMILES for triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane is c1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5cccc(-n6c7ccccc7c7cc([Si](c8ccccc8)(c8ccccc8)c8ccccc8)ccc76)c54)c3)c2)cc1.
What is the InChIKey of triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane?
The InChIKey is VRTHWZYOFJVUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H42N2Si/c1-5-20-43(21-6-1)44-22-17-23-45(40-44)46-24-18-25-47(41-46)61-56-35-15-13-32-52(56)54-34-19-37-59(60(54)61)62-57-36-16-14-33-53(57)55-42-51(38-39-58(55)62)63(48-26-7-2-8-27-48,49-28-9-3-10-29-49)50-30-11-4-12-31-50/h1-42H.
What are the key properties of triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane?
triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-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-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane is sourced from PubChem (CID 170515471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).