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

C54H37NOSi — CID 140702812

IUPAC[3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cccc(-c4ccc5oc6cc(-n7c8ccccc8c8ccccc87)ccc6c5c4)c3)c2)cc1
InChIInChI=1S/C54H37NOSi/c1-4-19-43(20-5-1)57(44-21-6-2-7-22-44,45-23-8-3-9-24-45)46-25-15-18-40(35-46)38-16-14-17-39(34-38)41-30-33-53-50(36-41)49-32-31-42(37-54(49)56-53)55-51-28-12-10-26-47(51)48-27-11-13-29-52(48)55/h1-37H
InChIKeyXRJOEVFTAUEAJK-UHFFFAOYSA-N
MW743.98 g/mol
LogP11.39
Rot. Bonds7

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

[3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane (PubChem CID 140702812) has the molecular formula C54H37NOSi and a molecular weight of 743.98 g/mol. Its IUPAC name is [3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane.

Molecular Properties

Compound Name[3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane
PubChem CID140702812
Molecular FormulaC54H37NOSi
Molecular Weight743.98 g/mol
Exact Mass743.26
IUPAC Name[3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cccc(-c4ccc5oc6cc(-n7c8ccccc8c8ccccc87)ccc6c5c4)c3)c2)cc1
InChIInChI=1S/C54H37NOSi/c1-4-19-43(20-5-1)57(44-21-6-2-7-22-44,45-23-8-3-9-24-45)46-25-15-18-40(35-46)38-16-14-17-39(34-38)41-30-33-53-50(36-41)49-32-31-42(37-54(49)56-53)55-51-28-12-10-26-47(51)48-27-11-13-29-52(48)55/h1-37H
InChIKeyXRJOEVFTAUEAJK-UHFFFAOYSA-N
XLogP11.39
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500743.98
LogP ≤ 511.39
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

[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-tris(3-methylphenyl)silane
CID 140702801
[3-[2-(2-dibenzofuran-3-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 166588280
[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]silane;diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane;diphenyl-[4-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane
CID 158196682
9-[8-[8-(8-carbazol-9-yldibenzofuran-2-yl)dibenzofuran-2-yl]dibenzofuran-2-yl]carbazole;9-[8-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]dibenzofuran-2-yl]carbazole
CID 158645763
[4-[4-(4-carbazol-9-ylphenyl)-6-(3-dibenzofuran-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane
CID 176722200
9-[8-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]dibenzofuran-3-yl]carbazole
CID 166952321
benzene;9-[8-(3-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]carbazole;ethene
CID 144788060
3-dibenzofuran-2-yl-9-dibenzofuran-3-ylcarbazole
CID 118504725
bis(18-carbazol-9-yl-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15(20),16,18-nonaen-6-yl)-diphenylsilane
CID 59147251
3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole
CID 170286211
9-dibenzofuran-2-yl-3-[3-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]phenyl]carbazole
CID 123613126
9-dibenzofuran-2-yl-3-[3-(3-dibenzofuran-2-ylphenyl)phenyl]carbazole
CID 123818422

Frequently Asked Questions

What is the IUPAC name of [3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane?
The IUPAC name of [3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane (CID 140702812) is [3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane.
What is the SMILES notation for [3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane?
The canonical SMILES for [3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane is c1ccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cccc(-c4ccc5oc6cc(-n7c8ccccc8c8ccccc87)ccc6c5c4)c3)c2)cc1.
What is the InChIKey of [3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane?
The InChIKey is XRJOEVFTAUEAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H37NOSi/c1-4-19-43(20-5-1)57(44-21-6-2-7-22-44,45-23-8-3-9-24-45)46-25-15-18-40(35-46)38-16-14-17-39(34-38)41-30-33-53-50(36-41)49-32-31-42(37-54(49)56-53)55-51-28-12-10-26-47(51)48-27-11-13-29-52(48)55/h1-37H.
What are the key properties of [3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane?
[3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane has a molecular weight of 743.98 g/mol, XLogP of 11.39, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-(7-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]-triphenylsilane is sourced from PubChem (CID 140702812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).