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

C168H109N13O3Si3 — CID 158131885

IUPACdibenzofuran-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
SMILESc1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2nccc([Si](c3ccccc3)(c3ccccc3)c3cccc4c3oc3ccccc34)n2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nccc([Si](c6ccccc6)(c6ccccc6)c6cccc7c6oc6ccccc67)n5)c4c32)cc1.c1ccc([Si](c2ccccc2)(c2ccnc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C64H41N5OSi.2C52H34N4OSi/c1-3-18-44(19-4-1)71(45-20-5-2-6-21-45,61-33-17-27-51-50-26-11-16-32-60(50)70-63(51)61)62-38-39-65-64(66-62)69-58-36-34-42(67-54-28-12-7-22-46(54)47-23-8-13-29-55(47)67)40-52(58)53-41-43(35-37-59(53)69)68-56-30-14-9-24-48(56)49-25-10-15-31-57(49)68;1-4-17-35(18-5-1)55-44-27-13-10-23-38(44)42-34-47-43(33-46(42)55)39-24-11-14-28-45(39)56(47)52-53-32-31-50(54-52)58(36-19-6-2-7-20-36,37-21-8-3-9-22-37)49-30-16-26-41-40-25-12-15-29-48(40)57-51(41)49;1-4-17-35(18-5-1)55-44-27-13-10-23-38(44)41-31-32-42-39-24-11-14-28-45(39)56(50(42)49(41)55)52-53-34-33-48(54-52)58(36-19-6-2-7-20-36,37-21-8-3-9-22-37)47-30-16-26-43-40-25-12-15-29-46(40)57-51(43)47/h1-41H;2*1-34H
InChIKeyFSWKHKWKGOFNHL-UHFFFAOYSA-N
MW2442.07 g/mol
LogP32.94
Rot. Bonds19

About 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

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 (PubChem CID 158131885) has the molecular formula C168H109N13O3Si3 and a molecular weight of 2442.07 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Namedibenzofuran-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
PubChem CID158131885
Molecular FormulaC168H109N13O3Si3
Molecular Weight2442.07 g/mol
Exact Mass2439.81
IUPAC Namedibenzofuran-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
SMILESc1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2nccc([Si](c3ccccc3)(c3ccccc3)c3cccc4c3oc3ccccc34)n2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nccc([Si](c6ccccc6)(c6ccccc6)c6cccc7c6oc6ccccc67)n5)c4c32)cc1.c1ccc([Si](c2ccccc2)(c2ccnc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C64H41N5OSi.2C52H34N4OSi/c1-3-18-44(19-4-1)71(45-20-5-2-6-21-45,61-33-17-27-51-50-26-11-16-32-60(50)70-63(51)61)62-38-39-65-64(66-62)69-58-36-34-42(67-54-28-12-7-22-46(54)47-23-8-13-29-55(47)67)40-52(58)53-41-43(35-37-59(53)69)68-56-30-14-9-24-48(56)49-25-10-15-31-57(49)68;1-4-17-35(18-5-1)55-44-27-13-10-23-38(44)42-34-47-43(33-46(42)55)39-24-11-14-28-45(39)56(47)52-53-32-31-50(54-52)58(36-19-6-2-7-20-36,37-21-8-3-9-22-37)49-30-16-26-41-40-25-12-15-29-48(40)57-51(41)49;1-4-17-35(18-5-1)55-44-27-13-10-23-38(44)41-31-32-42-39-24-11-14-28-45(39)56(50(42)49(41)55)52-53-34-33-48(54-52)58(36-19-6-2-7-20-36,37-21-8-3-9-22-37)47-30-16-26-43-40-25-12-15-29-46(40)57-51(43)47/h1-41H;2*1-34H
InChIKeyFSWKHKWKGOFNHL-UHFFFAOYSA-N
XLogP32.94
TPSA151.27 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds19
Heavy Atoms187
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002442.07
LogP ≤ 532.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 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 with MolForge

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Related Compounds

[2-(3-carbazol-9-ylcarbazol-9-yl)pyrimidin-5-yl]-dibenzofuran-4-yl-diphenylsilane
CID 140924385
[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
[4-[3-[3-([1]benzofuro[2,3-a]carbazol-12-yl)carbazol-9-yl]carbazol-9-yl]phenyl]-triphenylsilane
CID 166588195
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
dibenzofuran-4-yl-diphenyl-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenyl]silane
CID 89397692
[2-(3-carbazol-9-ylcarbazol-9-yl)pyrimidin-4-yl]-dibenzothiophen-4-yl-diphenylsilane;3-carbazol-9-yl-5-[dibenzofuran-4-yl(diphenyl)silyl]benzonitrile;(4-carbazol-9-yl-1,3,5-triazin-2-yl)-dibenzofuran-4-yl-diphenylsilane;(4-carbazol-9-yl-1,3,5-triazin-2-yl)-dibenzothiophen-4-yl-diphenylsilane
CID 161076535
[3-[3-[3-(3-carbazol-9-ylphenyl)phenyl]carbazol-9-yl]phenyl]-dibenzofuran-4-yl-diphenylsilane
CID 89397736
(8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane
CID 140811582
[3-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane;[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(3-carbazol-9-ylphenyl)-diphenylsilane;[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-(4-carbazol-9-ylphenyl)-diphenylsilane
CID 158577794
dibenzofuran-4-yl-diphenyl-[6-(9-pyridin-2-ylcarbazol-3-yl)-2-pyridinyl]silane
CID 140924367
3-carbazol-9-yl-11-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-12-(4-phenylphenyl)indolo[2,3-a]carbazole
CID 168729255
12-(4-dibenzofuran-2-yl-6-phenylpyrimidin-2-yl)-11-(9-phenylcarbazol-3-yl)indolo[2,3-a]carbazole
CID 140904004

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2nccc([Si](c3ccccc3)(c3ccccc3)c3cccc4c3oc3ccccc34)n2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nccc([Si](c6ccccc6)(c6ccccc6)c6cccc7c6oc6ccccc67)n5)c4c32)cc1.c1ccc([Si](c2ccccc2)(c2ccnc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of 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?
The InChIKey is FSWKHKWKGOFNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H41N5OSi.2C52H34N4OSi/c1-3-18-44(19-4-1)71(45-20-5-2-6-21-45,61-33-17-27-51-50-26-11-16-32-60(50)70-63(51)61)62-38-39-65-64(66-62)69-58-36-34-42(67-54-28-12-7-22-46(54)47-23-8-13-29-55(47)67)40-52(58)53-41-43(35-37-59(53)69)68-56-30-14-9-24-48(56)49-25-10-15-31-57(49)68;1-4-17-35(18-5-1)55-44-27-13-10-23-38(44)42-34-47-43(33-46(42)55)39-24-11-14-28-45(39)56(47)52-53-32-31-50(54-52)58(36-19-6-2-7-20-36,37-21-8-3-9-22-37)49-30-16-26-41-40-25-12-15-29-48(40)57-51(41)49;1-4-17-35(18-5-1)55-44-27-13-10-23-38(44)41-31-32-42-39-24-11-14-28-45(39)56(50(42)49(41)55)52-53-34-33-48(54-52)58(36-19-6-2-7-20-36,37-21-8-3-9-22-37)47-30-16-26-43-40-25-12-15-29-46(40)57-51(43)47/h1-41H;2*1-34H.
What are the key properties of 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?
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 has a molecular weight of 2442.07 g/mol, XLogP of 32.94, 19 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 158131885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).