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

C69H43N5S2Si — CID 140811539

IUPACdiphenyl-[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
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5sc6c([Si](c7ccccc7)(c7ccccc7)c7nccc8c7sc7ccc(-c9ccc%10c(c9)c9cccnc9n%10-c9ccccc9)cc78)nccc6c5c4)ccc32)cc1
InChIInChI=1S/C69H43N5S2Si/c1-5-16-48(17-6-1)73-60-26-14-13-24-52(60)56-40-44(27-31-61(56)73)46-29-33-63-58(42-46)53-35-38-71-68(65(53)75-63)77(50-20-9-3-10-21-50,51-22-11-4-12-23-51)69-66-54(36-39-72-69)59-43-47(30-34-64(59)76-66)45-28-32-62-57(41-45)55-25-15-37-70-67(55)74(62)49-18-7-2-8-19-49/h1-43H
InChIKeyHURFAWCAAUINCS-UHFFFAOYSA-N
MW1034.36 g/mol
LogP15.51
Rot. Bonds8

About 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

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 (PubChem CID 140811539) has the molecular formula C69H43N5S2Si and a molecular weight of 1034.36 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Namediphenyl-[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
PubChem CID140811539
Molecular FormulaC69H43N5S2Si
Molecular Weight1034.36 g/mol
Exact Mass1033.27
IUPAC Namediphenyl-[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
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5sc6c([Si](c7ccccc7)(c7ccccc7)c7nccc8c7sc7ccc(-c9ccc%10c(c9)c9cccnc9n%10-c9ccccc9)cc78)nccc6c5c4)ccc32)cc1
InChIInChI=1S/C69H43N5S2Si/c1-5-16-48(17-6-1)73-60-26-14-13-24-52(60)56-40-44(27-31-61(56)73)46-29-33-63-58(42-46)53-35-38-71-68(65(53)75-63)77(50-20-9-3-10-21-50,51-22-11-4-12-23-51)69-66-54(36-39-72-69)59-43-47(30-34-64(59)76-66)45-28-32-62-57(41-45)55-25-15-37-70-67(55)74(62)49-18-7-2-8-19-49/h1-43H
InChIKeyHURFAWCAAUINCS-UHFFFAOYSA-N
XLogP15.51
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms77
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001034.36
LogP ≤ 515.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 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 with MolForge

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Related Compounds

diphenyl-bis[8-(9-phenylcarbazol-3-yl)dibenzothiophen-4-yl]silane
CID 140811711
3,9-bis(9-phenylcarbazol-3-yl)carbazole;1,6-di(carbazol-9-yl)-[1]benzothiolo[2,3-c]pyridine
CID 159771301
9-dibenzothiophen-4-yl-6-[9-(3,5-diphenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole
CID 146187552
dibenzothiophen-4-yl-diphenyl-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenyl]silane
CID 89397676
3-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-9-phenylcarbazole
CID 138474901
6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylpyrido[2,3-b]indole
CID 168845228
9-(3-phenylphenyl)-6-[9-(3-phenylphenyl)carbazol-2-yl]pyrido[2,3-b]indole;9-(4-phenylphenyl)-6-[9-(3-phenylphenyl)carbazol-2-yl]pyrido[2,3-b]indole;9-(4-phenylphenyl)-6-[9-(4-phenylphenyl)carbazol-2-yl]pyrido[2,3-b]indole
CID 159710225
6-carbazol-9-yl-9-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]pyrido[2,3-b]indole
CID 70847781
9-(3,5-dipyridin-2-ylphenyl)-6-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 118587520
diphenyl-[8-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-[8-(9-phenylpyrido[3,4-b]indol-6-yl)dibenzothiophen-4-yl]silane
CID 140811572
diphenyl-(3-phenylphenyl)-(9-phenylpyrido[2,3-b]indol-6-yl)silane
CID 158596767
9-(8-pyrido[2,3-b]indol-9-yldibenzothiophen-2-yl)pyrido[2,3-b]indole
CID 132568147

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-n2c3ccccc3c3cc(-c4ccc5sc6c([Si](c7ccccc7)(c7ccccc7)c7nccc8c7sc7ccc(-c9ccc%10c(c9)c9cccnc9n%10-c9ccccc9)cc78)nccc6c5c4)ccc32)cc1.
What is the InChIKey of 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?
The InChIKey is HURFAWCAAUINCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H43N5S2Si/c1-5-16-48(17-6-1)73-60-26-14-13-24-52(60)56-40-44(27-31-61(56)73)46-29-33-63-58(42-46)53-35-38-71-68(65(53)75-63)77(50-20-9-3-10-21-50,51-22-11-4-12-23-51)69-66-54(36-39-72-69)59-43-47(30-34-64(59)76-66)45-28-32-62-57(41-45)55-25-15-37-70-67(55)74(62)49-18-7-2-8-19-49/h1-43H.
What are the key properties of 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?
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 has a molecular weight of 1034.36 g/mol, XLogP of 15.51, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 140811539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).