dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane

C46H31N3OSi — CID 140924367

IUPACdibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane
SMILESc1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccn3)n2)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C46H31N3OSi/c1-3-15-33(16-4-1)51(34-17-5-2-6-18-34,43-25-13-21-37-36-20-8-10-24-42(36)50-46(37)43)45-27-14-22-39(48-45)32-28-29-41-38(31-32)35-19-7-9-23-40(35)49(41)44-26-11-12-30-47-44/h1-31H
InChIKeyLADYACMWSBZVNA-UHFFFAOYSA-N
MW669.86 g/mol
LogP8.52
Rot. Bonds6

About dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane

dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane (PubChem CID 140924367) has the molecular formula C46H31N3OSi and a molecular weight of 669.86 g/mol. Its IUPAC name is dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane.

Molecular Properties

Compound Namedibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane
PubChem CID140924367
Molecular FormulaC46H31N3OSi
Molecular Weight669.86 g/mol
Exact Mass669.22
IUPAC Namedibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane
SMILESc1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccn3)n2)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C46H31N3OSi/c1-3-15-33(16-4-1)51(34-17-5-2-6-18-34,43-25-13-21-37-36-20-8-10-24-42(36)50-46(37)43)45-27-14-22-39(48-45)32-28-29-41-38(31-32)35-19-7-9-23-40(35)49(41)44-26-11-12-30-47-44/h1-31H
InChIKeyLADYACMWSBZVNA-UHFFFAOYSA-N
XLogP8.52
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500669.86
LogP ≤ 58.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane;dibenzofuran-4-yl-diphenyl-[2-(3-pyrido[2,3-b]indol-9-ylpyrido[2,3-b]indol-9-yl)pyrimidin-4-yl]silane;dibenzofuran-4-yl-diphenyl-[6-(9-pyrimidin-2-ylcarbazol-3-yl)-2-pyridinyl]silane
CID 159104461
3-(9-dibenzofuran-4-ylcarbazol-3-yl)-9-pyridin-2-ylcarbazole
CID 166905618
dibenzofuran-4-yl-diphenyl-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenyl]silane
CID 89397692
[3-[3-[3-(3-carbazol-9-ylphenyl)phenyl]carbazol-9-yl]phenyl]-dibenzofuran-4-yl-diphenylsilane
CID 89397736
dibenzofuran-4-yl-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]pyrimidin-4-yl]-diphenylsilane;dibenzofuran-4-yl-diphenyl-[2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]silane;dibenzofuran-4-yl-diphenyl-[2-(5-phenylindolo[3,2-b]carbazol-11-yl)pyrimidin-4-yl]silane
CID 158131885
[2-(3-carbazol-9-ylcarbazol-9-yl)pyrimidin-5-yl]-dibenzofuran-4-yl-diphenylsilane
CID 140924385
triphenyl-[6-[2-(9-phenylcarbazol-3-yl)phenyl]-2-pyridinyl]silane
CID 144577449
[3-[6-dibenzofuran-4-yl-2-(3-phenylcarbazol-9-yl)pyrimidin-4-yl]phenyl]-phenyl-bis(3-phenylphenyl)silane
CID 168836422
[3-[6-dibenzofuran-4-yl-2-(3-phenylcarbazol-9-yl)pyrimidin-4-yl]phenyl]-diphenyl-(3-phenylphenyl)silane
CID 168836375
dibenzofuran-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane;dibenzofuran-4-yl-diphenyl-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenyl]silane;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane
CID 159706684
6-dibenzofuran-2-yl-2-naphthalen-2-yl-9-pyridin-2-ylcarbazole
CID 163837269
[2-(3-carbazol-9-ylcarbazol-9-yl)pyrimidin-4-yl]-dibenzothiophen-4-yl-diphenylsilane;(4-carbazol-9-yl-1,3,5-triazin-2-yl)-dibenzofuran-4-yl-diphenylsilane
CID 161463718

Frequently Asked Questions

What is the IUPAC name of dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane?
The IUPAC name of dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane (CID 140924367) is dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane.
What is the SMILES notation for dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane?
The canonical SMILES for dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane is c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccn3)n2)c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane?
The InChIKey is LADYACMWSBZVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H31N3OSi/c1-3-15-33(16-4-1)51(34-17-5-2-6-18-34,43-25-13-21-37-36-20-8-10-24-42(36)50-46(37)43)45-27-14-22-39(48-45)32-28-29-41-38(31-32)35-19-7-9-23-40(35)49(41)44-26-11-12-30-47-44/h1-31H.
What are the key properties of dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane?
dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane has a molecular weight of 669.86 g/mol, XLogP of 8.52, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane is sourced from PubChem (CID 140924367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).