3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole

C135H84N12O3 — CID 165084980

IUPAC3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-n4c5ccccc5c5cc(-c6cccc7oc8ccccc8c67)ccc54)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3c4ccccc4c4cc(-c5cccc6oc7ccccc7c56)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc6oc7ccccc7c56)ccc43)n2)cc1
InChIInChI=1S/C51H32N4O.C45H28N4O.C39H24N4O/c1-3-13-33(14-4-1)35-25-27-36(28-26-35)49-52-50(39-18-11-17-37(31-39)34-15-5-2-6-16-34)54-51(53-49)55-44-22-9-7-19-41(44)43-32-38(29-30-45(43)55)40-21-12-24-47-48(40)42-20-8-10-23-46(42)56-47;1-3-14-29(15-4-1)43-46-44(30-16-5-2-6-17-30)48-45(47-43)34-19-8-11-23-38(34)49-37-22-10-7-18-33(37)36-28-31(26-27-39(36)49)32-21-13-25-41-42(32)35-20-9-12-24-40(35)50-41;1-3-12-25(13-4-1)37-40-38(26-14-5-2-6-15-26)42-39(41-37)43-32-19-9-7-16-29(32)31-24-27(22-23-33(31)43)28-18-11-21-35-36(28)30-17-8-10-20-34(30)44-35/h1-32H;1-28H;1-24H
InChIKeyVTASIUIZCFWRBO-UHFFFAOYSA-N
MW1922.24 g/mol
LogP34.61
Rot. Bonds15

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

3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 165084980) has the molecular formula C135H84N12O3 and a molecular weight of 1922.24 g/mol. Its IUPAC name is 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole.

Molecular Properties

Compound Name3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
PubChem CID165084980
Molecular FormulaC135H84N12O3
Molecular Weight1922.24 g/mol
Exact Mass1920.68
IUPAC Name3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-n4c5ccccc5c5cc(-c6cccc7oc8ccccc8c67)ccc54)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3c4ccccc4c4cc(-c5cccc6oc7ccccc7c56)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc6oc7ccccc7c56)ccc43)n2)cc1
InChIInChI=1S/C51H32N4O.C45H28N4O.C39H24N4O/c1-3-13-33(14-4-1)35-25-27-36(28-26-35)49-52-50(39-18-11-17-37(31-39)34-15-5-2-6-16-34)54-51(53-49)55-44-22-9-7-19-41(44)43-32-38(29-30-45(43)55)40-21-12-24-47-48(40)42-20-8-10-23-46(42)56-47;1-3-14-29(15-4-1)43-46-44(30-16-5-2-6-17-30)48-45(47-43)34-19-8-11-23-38(34)49-37-22-10-7-18-33(37)36-28-31(26-27-39(36)49)32-21-13-25-41-42(32)35-20-9-12-24-40(35)50-41;1-3-12-25(13-4-1)37-40-38(26-14-5-2-6-15-26)42-39(41-37)43-32-19-9-7-16-29(32)31-24-27(22-23-33(31)43)28-18-11-21-35-36(28)30-17-8-10-20-34(30)44-35/h1-32H;1-28H;1-24H
InChIKeyVTASIUIZCFWRBO-UHFFFAOYSA-N
XLogP34.61
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds15
Heavy Atoms150
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001922.24
LogP ≤ 534.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

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Frequently Asked Questions

What is the IUPAC name of 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole?
The IUPAC name of 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole (CID 165084980) is 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole.
What is the SMILES notation for 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole?
The canonical SMILES for 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole is c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-n4c5ccccc5c5cc(-c6cccc7oc8ccccc8c67)ccc54)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3c4ccccc4c4cc(-c5cccc6oc7ccccc7c56)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc6oc7ccccc7c56)ccc43)n2)cc1.
What is the InChIKey of 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole?
The InChIKey is VTASIUIZCFWRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H32N4O.C45H28N4O.C39H24N4O/c1-3-13-33(14-4-1)35-25-27-36(28-26-35)49-52-50(39-18-11-17-37(31-39)34-15-5-2-6-16-34)54-51(53-49)55-44-22-9-7-19-41(44)43-32-38(29-30-45(43)55)40-21-12-24-47-48(40)42-20-8-10-23-46(42)56-47;1-3-14-29(15-4-1)43-46-44(30-16-5-2-6-17-30)48-45(47-43)34-19-8-11-23-38(34)49-37-22-10-7-18-33(37)36-28-31(26-27-39(36)49)32-21-13-25-41-42(32)35-20-9-12-24-40(35)50-41;1-3-12-25(13-4-1)37-40-38(26-14-5-2-6-15-26)42-39(41-37)43-32-19-9-7-16-29(32)31-24-27(22-23-33(31)43)28-18-11-21-35-36(28)30-17-8-10-20-34(30)44-35/h1-32H;1-28H;1-24H.
What are the key properties of 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole?
3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole has a molecular weight of 1922.24 g/mol, XLogP of 34.61, 15 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole is sourced from PubChem (CID 165084980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).