3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole

C172H106N14O3 — CID 158764250

IUPAC3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8cccc9c8oc8ccccc89)cc7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8ccc9oc%10ccccc%10c9c8)cc7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8cccc9c8oc8ccccc89)cc7)c6c5)ccc43)n2)cc1
InChIInChI=1S/C58H36N4O.2C57H35N5O/c1-3-14-38(15-4-1)50-36-51(39-16-5-2-6-17-39)60-58(59-50)62-53-24-11-8-19-45(53)49-34-40(29-33-54(49)62)41-28-32-46-44-18-7-10-23-52(44)61(55(46)35-41)42-30-26-37(27-31-42)43-21-13-22-48-47-20-9-12-25-56(47)63-57(43)48;1-3-14-37(15-4-1)55-58-56(38-16-5-2-6-17-38)60-57(59-55)62-50-24-11-8-19-44(50)48-34-39(29-33-51(48)62)40-28-32-45-43-18-7-10-23-49(43)61(52(45)35-40)41-30-26-36(27-31-41)42-21-13-22-47-46-20-9-12-25-53(46)63-54(42)47;1-3-13-37(14-4-1)55-58-56(38-15-5-2-6-16-38)60-57(59-55)62-50-21-11-8-18-44(50)47-33-40(26-31-51(47)62)41-25-30-45-43-17-7-10-20-49(43)61(52(45)35-41)42-28-23-36(24-29-42)39-27-32-54-48(34-39)46-19-9-12-22-53(46)63-54/h1-36H;2*1-35H
InChIKeyIPBCKQFTZASBIN-UHFFFAOYSA-N
MW2416.83 g/mol
LogP44.50
Rot. Bonds18

About 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole

3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole (PubChem CID 158764250) has the molecular formula C172H106N14O3 and a molecular weight of 2416.83 g/mol. Its IUPAC name is 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole.

Molecular Properties

Compound Name3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
PubChem CID158764250
Molecular FormulaC172H106N14O3
Molecular Weight2416.83 g/mol
Exact Mass2414.86
IUPAC Name3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8cccc9c8oc8ccccc89)cc7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8ccc9oc%10ccccc%10c9c8)cc7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8cccc9c8oc8ccccc89)cc7)c6c5)ccc43)n2)cc1
InChIInChI=1S/C58H36N4O.2C57H35N5O/c1-3-14-38(15-4-1)50-36-51(39-16-5-2-6-17-39)60-58(59-50)62-53-24-11-8-19-45(53)49-34-40(29-33-54(49)62)41-28-32-46-44-18-7-10-23-52(44)61(55(46)35-41)42-30-26-37(27-31-42)43-21-13-22-48-47-20-9-12-25-56(47)63-57(43)48;1-3-14-37(15-4-1)55-58-56(38-16-5-2-6-17-38)60-57(59-55)62-50-24-11-8-19-44(50)48-34-39(29-33-51(48)62)40-28-32-45-43-18-7-10-23-49(43)61(52(45)35-40)41-30-26-36(27-31-41)42-21-13-22-47-46-20-9-12-25-53(46)63-54(42)47;1-3-13-37(14-4-1)55-58-56(38-15-5-2-6-16-38)60-57(59-55)62-50-21-11-8-18-44(50)47-33-40(26-31-51(47)62)41-25-30-45-43-17-7-10-20-49(43)61(52(45)35-41)42-28-23-36(24-29-42)39-27-32-54-48(34-39)46-19-9-12-22-53(46)63-54/h1-36H;2*1-35H
InChIKeyIPBCKQFTZASBIN-UHFFFAOYSA-N
XLogP44.50
TPSA172.12 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds18
Heavy Atoms189
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002416.83
LogP ≤ 544.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole?
The IUPAC name of 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole (CID 158764250) is 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole.
What is the SMILES notation for 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole?
The canonical SMILES for 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8cccc9c8oc8ccccc89)cc7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8ccc9oc%10ccccc%10c9c8)cc7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8cccc9c8oc8ccccc89)cc7)c6c5)ccc43)n2)cc1.
What is the InChIKey of 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole?
The InChIKey is IPBCKQFTZASBIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H36N4O.2C57H35N5O/c1-3-14-38(15-4-1)50-36-51(39-16-5-2-6-17-39)60-58(59-50)62-53-24-11-8-19-45(53)49-34-40(29-33-54(49)62)41-28-32-46-44-18-7-10-23-52(44)61(55(46)35-41)42-30-26-37(27-31-42)43-21-13-22-48-47-20-9-12-25-56(47)63-57(43)48;1-3-14-37(15-4-1)55-58-56(38-16-5-2-6-17-38)60-57(59-55)62-50-24-11-8-19-44(50)48-34-39(29-33-51(48)62)40-28-32-45-43-18-7-10-23-49(43)61(52(45)35-40)41-30-26-36(27-31-41)42-21-13-22-47-46-20-9-12-25-53(46)63-54(42)47;1-3-13-37(14-4-1)55-58-56(38-15-5-2-6-16-38)60-57(59-55)62-50-21-11-8-18-44(50)47-33-40(26-31-51(47)62)41-25-30-45-43-17-7-10-20-49(43)61(52(45)35-41)42-28-23-36(24-29-42)39-27-32-54-48(34-39)46-19-9-12-22-53(46)63-54/h1-36H;2*1-35H.
What are the key properties of 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole?
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole has a molecular weight of 2416.83 g/mol, XLogP of 44.50, 18 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole is sourced from PubChem (CID 158764250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).