[8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane

C56H32N4O3SSi — CID 140811724

IUPAC[8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2nccc3c2oc2c(-c4nccc5c4oc4ccccc45)cccc23)c2nccc3c2oc2c(-c4nccc5c4sc4ccccc45)cccc23)cc1
InChIInChI=1S/C56H32N4O3SSi/c1-3-13-33(14-4-1)65(34-15-5-2-6-16-34,55-52-40(26-31-59-55)37-19-11-21-43(49(37)62-52)47-51-39(25-29-57-47)35-17-7-9-23-45(35)61-51)56-53-41(27-32-60-56)38-20-12-22-44(50(38)63-53)48-54-42(28-30-58-48)36-18-8-10-24-46(36)64-54/h1-32H
InChIKeyCWPWURBCBRMOQE-UHFFFAOYSA-N
MW869.05 g/mol
LogP12.04
Rot. Bonds6

About [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane

[8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane (PubChem CID 140811724) has the molecular formula C56H32N4O3SSi and a molecular weight of 869.05 g/mol. Its IUPAC name is [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane.

Molecular Properties

Compound Name[8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane
PubChem CID140811724
Molecular FormulaC56H32N4O3SSi
Molecular Weight869.05 g/mol
Exact Mass868.20
IUPAC Name[8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2nccc3c2oc2c(-c4nccc5c4oc4ccccc45)cccc23)c2nccc3c2oc2c(-c4nccc5c4sc4ccccc45)cccc23)cc1
InChIInChI=1S/C56H32N4O3SSi/c1-3-13-33(14-4-1)65(34-15-5-2-6-16-34,55-52-40(26-31-59-55)37-19-11-21-43(49(37)62-52)47-51-39(25-29-57-47)35-17-7-9-23-45(35)61-51)56-53-41(27-32-60-56)38-20-12-22-44(50(38)63-53)48-54-42(28-30-58-48)36-18-8-10-24-46(36)64-54/h1-32H
InChIKeyCWPWURBCBRMOQE-UHFFFAOYSA-N
XLogP12.04
TPSA90.98 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500869.05
LogP ≤ 512.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane with MolForge

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Related Compounds

[6-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[6-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzothiolo[2,3-c]pyridin-1-yl]-diphenylsilane
CID 140811693
6-[2-[2-([1]benzothiolo[2,3-c]pyridin-1-yl)phenyl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 155101137
(6-dibenzofuran-4-yldibenzofuran-4-yl)-(6-dibenzothiophen-4-yldibenzofuran-4-yl)-diphenylsilane
CID 140811666
bis[6-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane
CID 140811588
(8-dibenzofuran-4-yldibenzofuran-4-yl)-(8-dibenzothiophen-4-yldibenzofuran-4-yl)-diphenylsilane
CID 140811543
4-dibenzofuran-4-yl-2-dibenzothiophen-4-ylpyrimidine
CID 155078239
bis(6-dibenzofuran-4-yldibenzofuran-4-yl)-diphenylsilane;bis(8-dibenzofuran-2-yldibenzofuran-4-yl)-diphenylsilane;bis(6-dibenzothiophen-4-yldibenzothiophen-4-yl)-diphenylsilane;bis(8-dibenzothiophen-4-yldibenzothiophen-4-yl)-diphenylsilane
CID 157266502
1-[2-(2-phenylphenyl)phenyl]-[1]benzothiolo[2,3-c]pyridine
CID 155101157
2-(3-dibenzofuran-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine;2-dibenzothiophen-4-yl-4,6-diphenyl-1,3,5-triazine
CID 144953430
3-dibenzofuran-4-yl-[1]benzothiolo[3,2-c]pyridine
CID 170531478
2-(4-dibenzofuran-4-ylphenyl)-4-(3-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazine
CID 130288940
2-dibenzofuran-4-yl-4-dibenzothiophen-4-yl-6-methyl-1,3,5-triazine
CID 155603268

Frequently Asked Questions

What is the IUPAC name of [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane?
The IUPAC name of [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane (CID 140811724) is [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane.
What is the SMILES notation for [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane?
The canonical SMILES for [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane is c1ccc([Si](c2ccccc2)(c2nccc3c2oc2c(-c4nccc5c4oc4ccccc45)cccc23)c2nccc3c2oc2c(-c4nccc5c4sc4ccccc45)cccc23)cc1.
What is the InChIKey of [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane?
The InChIKey is CWPWURBCBRMOQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H32N4O3SSi/c1-3-13-33(14-4-1)65(34-15-5-2-6-16-34,55-52-40(26-31-59-55)37-19-11-21-43(49(37)62-52)47-51-39(25-29-57-47)35-17-7-9-23-45(35)61-51)56-53-41(27-32-60-56)38-20-12-22-44(50(38)63-53)48-54-42(28-30-58-48)36-18-8-10-24-46(36)64-54/h1-32H.
What are the key properties of [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane?
[8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane has a molecular weight of 869.05 g/mol, XLogP of 12.04, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [8-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[8-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane is sourced from PubChem (CID 140811724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).