dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane

C44H30N2OSi — CID 153422269

IUPACdibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2cccc(-n3c4ccccc4n4c5ccccc5cc34)c2)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C44H30N2OSi/c1-3-17-33(18-4-1)48(34-19-5-2-6-20-34,42-28-14-23-37-36-22-8-12-27-41(36)47-44(37)42)35-21-13-16-32(30-35)45-39-25-10-11-26-40(39)46-38-24-9-7-15-31(38)29-43(45)46/h1-30H
InChIKeyJOXWLSSCDLSCMS-UHFFFAOYSA-N
MW630.82 g/mol
LogP8.31
Rot. Bonds5

About dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane

dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane (PubChem CID 153422269) has the molecular formula C44H30N2OSi and a molecular weight of 630.82 g/mol. Its IUPAC name is dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane.

Molecular Properties

Compound Namedibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane
PubChem CID153422269
Molecular FormulaC44H30N2OSi
Molecular Weight630.82 g/mol
Exact Mass630.21
IUPAC Namedibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2cccc(-n3c4ccccc4n4c5ccccc5cc34)c2)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C44H30N2OSi/c1-3-17-33(18-4-1)48(34-19-5-2-6-20-34,42-28-14-23-37-36-22-8-12-27-41(36)47-44(37)42)35-21-13-16-32(30-35)45-39-25-10-11-26-40(39)46-38-24-9-7-15-31(38)29-43(45)46/h1-30H
InChIKeyJOXWLSSCDLSCMS-UHFFFAOYSA-N
XLogP8.31
TPSA22.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500630.82
LogP ≤ 58.31
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

[3-(benzimidazolo[1,2-a]benzimidazol-5-yl)phenyl]-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane;benzimidazolo[2,1-b][1,3]benzothiazol-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane;benzimidazolo[2,1-b][1,3]benzoxazol-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane;dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane
CID 161061115
[3-[3-[3-(3-carbazol-9-ylphenyl)phenyl]carbazol-9-yl]phenyl]-dibenzofuran-4-yl-diphenylsilane
CID 89397736
[3-(3-carbazol-9-ylindolo[1,2-a]benzimidazol-10-yl)phenyl]-dibenzothiophen-4-yl-diphenylsilane;dibenzothiophen-4-yl-[3-(3-indolo[1,2-a]benzimidazol-10-ylindolo[1,2-a]benzimidazol-10-yl)phenyl]-diphenylsilane;dibenzothiophen-4-yl-[3-(7-indolo[1,2-a]benzimidazol-10-ylindolo[1,2-a]benzimidazol-10-yl)phenyl]-diphenylsilane
CID 160634786
dibenzofuran-4-yl-diphenyl-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenyl]silane
CID 89397692
dibenzofuran-4-yl-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-diphenylsilane
CID 164757103
[2-(3-carbazol-9-ylcarbazol-9-yl)pyrimidin-5-yl]-dibenzofuran-4-yl-diphenylsilane
CID 140924385
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
[3-(1-dibenzofuran-4-ylcarbazol-9-yl)phenyl]-triphenylsilane
CID 177073497
[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-[3-(17-carbazol-9-yl-3-oxa-14,21,23-triazahexacyclo[11.10.0.02,10.04,9.014,22.015,20]tricosa-1(13),2(10),4,6,8,11,15(20),16,18,22-decaen-21-yl)phenyl]-diphenylsilane
CID 176725053
[1]benzofuro[3,2-d]pyrimidin-4-yl-(3-carbazol-9-ylphenyl)-diphenylsilane
CID 171723046
[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(4-bromophenyl)-diphenylsilane
CID 140842642
(8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane
CID 140811582

Frequently Asked Questions

What is the IUPAC name of dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane?
The IUPAC name of dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane (CID 153422269) is dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane.
What is the SMILES notation for dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane?
The canonical SMILES for dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane is c1ccc([Si](c2ccccc2)(c2cccc(-n3c4ccccc4n4c5ccccc5cc34)c2)c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane?
The InChIKey is JOXWLSSCDLSCMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H30N2OSi/c1-3-17-33(18-4-1)48(34-19-5-2-6-20-34,42-28-14-23-37-36-22-8-12-27-41(36)47-44(37)42)35-21-13-16-32(30-35)45-39-25-10-11-26-40(39)46-38-24-9-7-15-31(38)29-43(45)46/h1-30H.
What are the key properties of dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane?
dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane has a molecular weight of 630.82 g/mol, XLogP of 8.31, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran-4-yl-(3-indolo[1,2-a]benzimidazol-10-ylphenyl)-diphenylsilane is sourced from PubChem (CID 153422269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).