[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane

C60H41N3Si — CID 170516315

IUPAC[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane
SMILESc1ccc(-n2c3ccccc3c3cc(-n4c5cc(-n6c7ccccc7c7ccccc76)ccc5c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc54)ccc32)cc1
InChIInChI=1S/C60H41N3Si/c1-5-19-42(20-6-1)61-57-32-18-15-29-51(57)54-39-43(34-38-58(54)61)63-59-40-44(62-55-30-16-13-27-49(55)50-28-14-17-31-56(50)62)33-36-52(59)53-37-35-48(41-60(53)63)64(45-21-7-2-8-22-45,46-23-9-3-10-24-46)47-25-11-4-12-26-47/h1-41H
InChIKeyFYCFZDAVAHHOII-UHFFFAOYSA-N
MW832.10 g/mol
LogP12.36
Rot. Bonds7

About [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane

[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane (PubChem CID 170516315) has the molecular formula C60H41N3Si and a molecular weight of 832.10 g/mol. Its IUPAC name is [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane.

Molecular Properties

Compound Name[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane
PubChem CID170516315
Molecular FormulaC60H41N3Si
Molecular Weight832.10 g/mol
Exact Mass831.31
IUPAC Name[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane
SMILESc1ccc(-n2c3ccccc3c3cc(-n4c5cc(-n6c7ccccc7c7ccccc76)ccc5c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc54)ccc32)cc1
InChIInChI=1S/C60H41N3Si/c1-5-19-42(20-6-1)61-57-32-18-15-29-51(57)54-39-43(34-38-58(54)61)63-59-40-44(62-55-30-16-13-27-49(55)50-28-14-17-31-56(50)62)33-36-52(59)53-37-35-48(41-60(53)63)64(45-21-7-2-8-22-45,46-23-9-3-10-24-46)47-25-11-4-12-26-47/h1-41H
InChIKeyFYCFZDAVAHHOII-UHFFFAOYSA-N
XLogP12.36
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500832.10
LogP ≤ 512.36
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

diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 89393751
triphenyl-[3-[2-[2-(2-triphenylsilylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588700
[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 159773868
triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
CID 170515813
diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane
CID 140842640
[6-(4-carbazol-9-ylphenyl)-9-phenylcarbazol-2-yl]-triphenylsilane
CID 140778740
[9-[7-carbazol-9-yl-9-(4-phenylphenyl)carbazol-2-yl]carbazol-3-yl]-triphenylsilane
CID 170515024
triphenyl-[6-(2-phenylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 170516502
triphenyl-[3-[3-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588203
triphenyl-[4-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166589115
dibenzothiophen-2-yl-diphenyl-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
CID 170779721
2-(3-carbazol-9-ylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazole
CID 121274440

Frequently Asked Questions

What is the IUPAC name of [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane?
The IUPAC name of [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane (CID 170516315) is [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane.
What is the SMILES notation for [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane?
The canonical SMILES for [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane is c1ccc(-n2c3ccccc3c3cc(-n4c5cc(-n6c7ccccc7c7ccccc76)ccc5c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc54)ccc32)cc1.
What is the InChIKey of [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane?
The InChIKey is FYCFZDAVAHHOII-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H41N3Si/c1-5-19-42(20-6-1)61-57-32-18-15-29-51(57)54-39-43(34-38-58(54)61)63-59-40-44(62-55-30-16-13-27-49(55)50-28-14-17-31-56(50)62)33-36-52(59)53-37-35-48(41-60(53)63)64(45-21-7-2-8-22-45,46-23-9-3-10-24-46)47-25-11-4-12-26-47/h1-41H.
What are the key properties of [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane?
[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane has a molecular weight of 832.10 g/mol, XLogP of 12.36, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane is sourced from PubChem (CID 170516315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).