[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole

C192H123N7O3Si — CID 158007858

IUPAC[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6c5oc5ccccc56)cc4)ccc32)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)cc2)cc1.c1ccc2c(c1)oc1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)ccc12
InChIInChI=1S/C54H35N3.C48H30N2O.C48H29NO.C42H29NOSi/c1-4-14-40(15-5-1)55-49-22-12-10-20-43(49)45-32-36(24-28-51(45)55)38-26-30-53-47(34-38)48-35-39(27-31-54(48)57(53)42-18-8-3-9-19-42)37-25-29-52-46(33-37)44-21-11-13-23-50(44)56(52)41-16-6-2-7-17-41;1-2-11-34(12-3-1)49-43-18-7-4-13-37(43)41-29-32(23-27-45(41)49)33-24-28-46-42(30-33)38-14-5-8-19-44(38)50(46)35-25-21-31(22-26-35)36-16-10-17-40-39-15-6-9-20-47(39)51-48(36)40;1-2-11-37-35(9-1)36-10-3-4-12-38(36)43-27-31(19-24-39(37)43)30-17-22-34(23-18-30)49-45-15-7-5-13-40(45)44-28-32(21-26-46(44)49)33-20-25-42-41-14-6-8-16-47(41)50-48(42)29-33;1-4-14-31(15-5-1)45(32-16-6-2-7-17-32,33-18-8-3-9-19-33)34-26-24-30(25-27-34)43-38-22-12-10-21-37(38)41-39(43)29-28-36-35-20-11-13-23-40(35)44-42(36)41/h1-35H;1-30H;1-29H;1-29H
InChIKeyFEMYFIYLYOFLFW-UHFFFAOYSA-N
MW2604.23 g/mol
LogP48.96
Rot. Bonds17

About [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole

[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole (PubChem CID 158007858) has the molecular formula C192H123N7O3Si and a molecular weight of 2604.23 g/mol. Its IUPAC name is [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole.

Molecular Properties

Compound Name[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole
PubChem CID158007858
Molecular FormulaC192H123N7O3Si
Molecular Weight2604.23 g/mol
Exact Mass2601.95
IUPAC Name[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6c5oc5ccccc56)cc4)ccc32)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)cc2)cc1.c1ccc2c(c1)oc1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)ccc12
InChIInChI=1S/C54H35N3.C48H30N2O.C48H29NO.C42H29NOSi/c1-4-14-40(15-5-1)55-49-22-12-10-20-43(49)45-32-36(24-28-51(45)55)38-26-30-53-47(34-38)48-35-39(27-31-54(48)57(53)42-18-8-3-9-19-42)37-25-29-52-46(33-37)44-21-11-13-23-50(44)56(52)41-16-6-2-7-17-41;1-2-11-34(12-3-1)49-43-18-7-4-13-37(43)41-29-32(23-27-45(41)49)33-24-28-46-42(30-33)38-14-5-8-19-44(38)50(46)35-25-21-31(22-26-35)36-16-10-17-40-39-15-6-9-20-47(39)51-48(36)40;1-2-11-37-35(9-1)36-10-3-4-12-38(36)43-27-31(19-24-39(37)43)30-17-22-34(23-18-30)49-45-15-7-5-13-40(45)44-28-32(21-26-46(44)49)33-20-25-42-41-14-6-8-16-47(41)50-48(42)29-33;1-4-14-31(15-5-1)45(32-16-6-2-7-17-32,33-18-8-3-9-19-33)34-26-24-30(25-27-34)43-38-22-12-10-21-37(38)41-39(43)29-28-36-35-20-11-13-23-40(35)44-42(36)41/h1-35H;1-30H;1-29H;1-29H
InChIKeyFEMYFIYLYOFLFW-UHFFFAOYSA-N
XLogP48.96
TPSA73.93 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds17
Heavy Atoms203
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002604.23
LogP ≤ 548.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole?
The IUPAC name of [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole (CID 158007858) is [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole.
What is the SMILES notation for [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole?
The canonical SMILES for [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6c5oc5ccccc56)cc4)ccc32)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)cc2)cc1.c1ccc2c(c1)oc1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)ccc12.
What is the InChIKey of [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole?
The InChIKey is FEMYFIYLYOFLFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H35N3.C48H30N2O.C48H29NO.C42H29NOSi/c1-4-14-40(15-5-1)55-49-22-12-10-20-43(49)45-32-36(24-28-51(45)55)38-26-30-53-47(34-38)48-35-39(27-31-54(48)57(53)42-18-8-3-9-19-42)37-25-29-52-46(33-37)44-21-11-13-23-50(44)56(52)41-16-6-2-7-17-41;1-2-11-34(12-3-1)49-43-18-7-4-13-37(43)41-29-32(23-27-45(41)49)33-24-28-46-42(30-33)38-14-5-8-19-44(38)50(46)35-25-21-31(22-26-35)36-16-10-17-40-39-15-6-9-20-47(39)51-48(36)40;1-2-11-37-35(9-1)36-10-3-4-12-38(36)43-27-31(19-24-39(37)43)30-17-22-34(23-18-30)49-45-15-7-5-13-40(45)44-28-32(21-26-46(44)49)33-20-25-42-41-14-6-8-16-47(41)50-48(42)29-33;1-4-14-31(15-5-1)45(32-16-6-2-7-17-32,33-18-8-3-9-19-33)34-26-24-30(25-27-34)43-38-22-12-10-21-37(38)41-39(43)29-28-36-35-20-11-13-23-40(35)44-42(36)41/h1-35H;1-30H;1-29H;1-29H.
What are the key properties of [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole?
[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole has a molecular weight of 2604.23 g/mol, XLogP of 48.96, 17 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-triphenylsilane;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-9-(4-triphenylen-2-ylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole is sourced from PubChem (CID 158007858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).