dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane

C60H40N2OSi — CID 171458080

IUPACdibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane
SMILESc1ccc(-c2ccccc2-n2c3ccccc3c3c(-n4c5ccccc5c5c([Si](c6ccccc6)(c6ccccc6)c6ccc7oc8ccccc8c7c6)cccc54)cccc32)cc1
InChIInChI=1S/C60H40N2OSi/c1-4-20-41(21-5-1)45-26-10-14-30-50(45)61-51-31-15-11-28-47(51)59-53(61)33-18-34-54(59)62-52-32-16-12-29-48(52)60-55(62)35-19-37-58(60)64(42-22-6-2-7-23-42,43-24-8-3-9-25-43)44-38-39-57-49(40-44)46-27-13-17-36-56(46)63-57/h1-40H
InChIKeyYCXYIXONGUSHJR-UHFFFAOYSA-N
MW833.08 g/mol
LogP12.82
Rot. Bonds7

About dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane

dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane (PubChem CID 171458080) has the molecular formula C60H40N2OSi and a molecular weight of 833.08 g/mol. Its IUPAC name is dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane.

Molecular Properties

Compound Namedibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane
PubChem CID171458080
Molecular FormulaC60H40N2OSi
Molecular Weight833.08 g/mol
Exact Mass832.29
IUPAC Namedibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane
SMILESc1ccc(-c2ccccc2-n2c3ccccc3c3c(-n4c5ccccc5c5c([Si](c6ccccc6)(c6ccccc6)c6ccc7oc8ccccc8c7c6)cccc54)cccc32)cc1
InChIInChI=1S/C60H40N2OSi/c1-4-20-41(21-5-1)45-26-10-14-30-50(45)61-51-31-15-11-28-47(51)59-53(61)33-18-34-54(59)62-52-32-16-12-29-48(52)60-55(62)35-19-37-58(60)64(42-22-6-2-7-23-42,43-24-8-3-9-25-43)44-38-39-57-49(40-44)46-27-13-17-36-56(46)63-57/h1-40H
InChIKeyYCXYIXONGUSHJR-UHFFFAOYSA-N
XLogP12.82
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500833.08
LogP ≤ 512.82
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

dibenzofuran-2-yl-[3-[4-[4-[diphenyl-(4-phenylphenyl)silyl]carbazol-9-yl]carbazol-9-yl]phenyl]-diphenylsilane
CID 171457910
[9-[5-carbazol-9-yl-9-(2-phenylphenyl)carbazol-2-yl]carbazol-4-yl]-triphenylsilane
CID 170516363
dibenzofuran-4-yl-[9-[9-[4-[diphenyl-(3-phenylphenyl)silyl]phenyl]carbazol-4-yl]carbazol-4-yl]-diphenylsilane
CID 171458316
triphenyl-[8-phenyl-9-(9-phenylcarbazol-4-yl)carbazol-4-yl]silane
CID 170516087
[9-(5,9-diphenylcarbazol-4-yl)carbazol-4-yl]-triphenylsilane
CID 170516212
triphenyl-[9-[5-phenyl-9-(2-phenylphenyl)carbazol-3-yl]carbazol-4-yl]silane
CID 171458587
diphenyl-(3-phenylphenyl)-[9-[9-(2-phenylphenyl)carbazol-2-yl]carbazol-4-yl]silane
CID 171458387
dibenzofuran-2-yl-diphenyl-[3-[3-(3-phenylcarbazol-9-yl)-5-triphenylsilylcarbazol-9-yl]phenyl]silane
CID 171457987
triphenyl-[9-(9-phenylcarbazol-4-yl)carbazol-4-yl]silane
CID 170515887
triphenyl-[9-[8-phenyl-9-(2-phenylphenyl)carbazol-2-yl]carbazol-4-yl]silane
CID 170515756
dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane
CID 170779740
[3-[4-(4-dibenzofuran-2-ylcarbazol-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-triphenylsilane
CID 176837798

Frequently Asked Questions

What is the IUPAC name of dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane?
The IUPAC name of dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane (CID 171458080) is dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane.
What is the SMILES notation for dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane?
The canonical SMILES for dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane is c1ccc(-c2ccccc2-n2c3ccccc3c3c(-n4c5ccccc5c5c([Si](c6ccccc6)(c6ccccc6)c6ccc7oc8ccccc8c7c6)cccc54)cccc32)cc1.
What is the InChIKey of dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane?
The InChIKey is YCXYIXONGUSHJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2OSi/c1-4-20-41(21-5-1)45-26-10-14-30-50(45)61-51-31-15-11-28-47(51)59-53(61)33-18-34-54(59)62-52-32-16-12-29-48(52)60-55(62)35-19-37-58(60)64(42-22-6-2-7-23-42,43-24-8-3-9-25-43)44-38-39-57-49(40-44)46-27-13-17-36-56(46)63-57/h1-40H.
What are the key properties of dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane?
dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane has a molecular weight of 833.08 g/mol, XLogP of 12.82, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran-2-yl-diphenyl-[9-[9-(2-phenylphenyl)carbazol-4-yl]carbazol-4-yl]silane is sourced from PubChem (CID 171458080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).