[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

C56H32N4OS3Si — CID 140811693

IUPAC[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
SMILESc1ccc([Si](c2ccccc2)(c2nccc3c2oc2ccc(-c4nccc5c4sc4ccccc45)cc23)c2nccc3c2sc2ccc(-c4nccc5c4sc4ccccc45)cc23)cc1
InChIInChI=1S/C56H32N4OS3Si/c1-3-11-35(12-4-1)65(36-13-5-2-6-14-36,55-51-39(23-29-59-55)43-31-33(19-21-45(43)61-51)49-52-40(24-27-57-49)37-15-7-9-17-46(37)62-52)56-54-42(26-30-60-56)44-32-34(20-22-48(44)64-54)50-53-41(25-28-58-50)38-16-8-10-18-47(38)63-53/h1-32H
InChIKeySZQFRCPYEFPOOL-UHFFFAOYSA-N
MW901.19 g/mol
LogP12.98
Rot. Bonds6

About [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

[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 (PubChem CID 140811693) has the molecular formula C56H32N4OS3Si and a molecular weight of 901.19 g/mol. Its IUPAC name is [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.

Molecular Properties

Compound Name[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
PubChem CID140811693
Molecular FormulaC56H32N4OS3Si
Molecular Weight901.19 g/mol
Exact Mass900.15
IUPAC Name[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
SMILESc1ccc([Si](c2ccccc2)(c2nccc3c2oc2ccc(-c4nccc5c4sc4ccccc45)cc23)c2nccc3c2sc2ccc(-c4nccc5c4sc4ccccc45)cc23)cc1
InChIInChI=1S/C56H32N4OS3Si/c1-3-11-35(12-4-1)65(36-13-5-2-6-14-36,55-51-39(23-29-59-55)43-31-33(19-21-45(43)61-51)49-52-40(24-27-57-49)37-15-7-9-17-46(37)62-52)56-54-42(26-30-60-56)44-32-34(20-22-48(44)64-54)50-53-41(25-28-58-50)38-16-8-10-18-47(38)63-53/h1-32H
InChIKeySZQFRCPYEFPOOL-UHFFFAOYSA-N
XLogP12.98
TPSA64.70 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500901.19
LogP ≤ 512.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze [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 with MolForge

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Related Compounds

bis[6-([1]benzofuro[2,3-c]pyridin-1-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-diphenylsilane
CID 140811588
[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
(8-dibenzofuran-4-yldibenzofuran-4-yl)-(8-dibenzothiophen-4-yldibenzofuran-4-yl)-diphenylsilane
CID 140811543
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-naphthalen-2-yl-[1]benzothiolo[2,3-c]pyridine
CID 176651602
diphenyl-[6-(9-phenylcarbazol-3-yl)-[1]benzothiolo[2,3-c]pyridin-1-yl]-[6-(9-phenylpyrido[2,3-b]indol-6-yl)-[1]benzothiolo[2,3-c]pyridin-1-yl]silane
CID 140811539
6-dibenzothiophen-2-yl-2-[3-(4-phenylphenyl)phenyl]dibenzofuran
CID 118349956
[3-([1]benzothiolo[2,3-c]pyridin-1-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane
CID 123944245
20-dibenzothiophen-4-yl-16-oxahexacyclo[12.11.0.02,7.08,13.015,23.017,22]pentacosa-1(14),2,4,6,8,10,12,15(23),17(22),18,20,24-dodecaene
CID 89348416
(6-carbazol-9-yldibenzofuran-4-yl)-(6-carbazol-9-yldibenzothiophen-4-yl)-diphenylsilane;diphenyl-[6-(9-phenylpyrido[3,4-b]indol-3-yl)-[1]benzofuro[2,3-c]pyridin-1-yl]-[6-(9-phenylpyrido[3,4-b]indol-3-yl)-[1]benzothiolo[2,3-c]pyridin-1-yl]silane;diphenyl-(6-pyrido[4,3-b]indol-5-yldibenzofuran-4-yl)-(6-pyrido[4,3-b]indol-5-yldibenzothiophen-4-yl)silane;diphenyl-(8-pyrido[3,2-b]indol-5-yldibenzofuran-4-yl)-(8-pyrido[3,2-b]indol-5-yldibenzothiophen-4-yl)silane;diphenyl-(8-pyrido[3,4-b]indol-9-yldibenzofuran-4-yl)-(8-pyrido[3,4-b]indol-9-yldibenzothiophen-4-yl)silane
CID 159489633
diphenyl-[8-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-[8-(9-phenylpyrido[3,4-b]indol-6-yl)dibenzothiophen-4-yl]silane
CID 140811572
4-[3-(3-dibenzothiophen-2-ylphenyl)phenyl]-8-phenyl-[1]benzofuro[3,2-d]pyrimidine
CID 156578604

Frequently Asked Questions

What is the IUPAC name of [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?
The IUPAC name of [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) is [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.
What is the SMILES notation for [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?
The canonical SMILES for [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 is c1ccc([Si](c2ccccc2)(c2nccc3c2oc2ccc(-c4nccc5c4sc4ccccc45)cc23)c2nccc3c2sc2ccc(-c4nccc5c4sc4ccccc45)cc23)cc1.
What is the InChIKey of [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?
The InChIKey is SZQFRCPYEFPOOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H32N4OS3Si/c1-3-11-35(12-4-1)65(36-13-5-2-6-14-36,55-51-39(23-29-59-55)43-31-33(19-21-45(43)61-51)49-52-40(24-27-57-49)37-15-7-9-17-46(37)62-52)56-54-42(26-30-60-56)44-32-34(20-22-48(44)64-54)50-53-41(25-28-58-50)38-16-8-10-18-47(38)63-53/h1-32H.
What are the key properties of [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?
[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 has a molecular weight of 901.19 g/mol, XLogP of 12.98, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [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 is sourced from PubChem (CID 140811693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).