2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole

C118H74N8O2 — CID 158529955

IUPAC2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6ccc(-c7ccc8oc9ccccc9c8c7)cc65)c4)n3)cc21.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc7oc8ccccc8c7c6)cc54)c3)nc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)n2)cc1
InChIInChI=1S/C64H38N4O.C54H36N4O/c1-2-16-39(17-3-1)61-65-62(67-63(66-61)50-25-15-29-55-60(50)49-24-6-11-28-54(49)64(55)52-26-9-4-20-44(52)45-21-5-10-27-53(45)64)42-18-14-19-43(36-42)68-56-30-12-7-22-46(56)47-34-32-41(38-57(47)68)40-33-35-59-51(37-40)48-23-8-13-31-58(48)69-59;1-54(2)45-20-9-6-17-39(45)40-26-24-37(31-46(40)54)53-56-51(33-13-4-3-5-14-33)55-52(57-53)36-15-12-16-38(29-36)58-47-21-10-7-18-41(47)42-27-23-35(32-48(42)58)34-25-28-50-44(30-34)43-19-8-11-22-49(43)59-50/h1-38H;3-32H,1-2H3
InChIKeyHNFXXUCMVGIUFH-UHFFFAOYSA-N
MW1635.94 g/mol
LogP29.72
Rot. Bonds10

About 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole

2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole (PubChem CID 158529955) has the molecular formula C118H74N8O2 and a molecular weight of 1635.94 g/mol. Its IUPAC name is 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole.

Molecular Properties

Compound Name2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole
PubChem CID158529955
Molecular FormulaC118H74N8O2
Molecular Weight1635.94 g/mol
Exact Mass1634.59
IUPAC Name2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6ccc(-c7ccc8oc9ccccc9c8c7)cc65)c4)n3)cc21.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc7oc8ccccc8c7c6)cc54)c3)nc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)n2)cc1
InChIInChI=1S/C64H38N4O.C54H36N4O/c1-2-16-39(17-3-1)61-65-62(67-63(66-61)50-25-15-29-55-60(50)49-24-6-11-28-54(49)64(55)52-26-9-4-20-44(52)45-21-5-10-27-53(45)64)42-18-14-19-43(36-42)68-56-30-12-7-22-46(56)47-34-32-41(38-57(47)68)40-33-35-59-51(37-40)48-23-8-13-31-58(48)69-59;1-54(2)45-20-9-6-17-39(45)40-26-24-37(31-46(40)54)53-56-51(33-13-4-3-5-14-33)55-52(57-53)36-15-12-16-38(29-36)58-47-21-10-7-18-41(47)42-27-23-35(32-48(42)58)34-25-28-50-44(30-34)43-19-8-11-22-49(43)59-50/h1-38H;3-32H,1-2H3
InChIKeyHNFXXUCMVGIUFH-UHFFFAOYSA-N
XLogP29.72
TPSA113.48 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds10
Heavy Atoms128
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001635.94
LogP ≤ 529.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole?
The IUPAC name of 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole (CID 158529955) is 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole.
What is the SMILES notation for 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole?
The canonical SMILES for 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole is CC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6ccc(-c7ccc8oc9ccccc9c8c7)cc65)c4)n3)cc21.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc7oc8ccccc8c7c6)cc54)c3)nc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)n2)cc1.
What is the InChIKey of 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole?
The InChIKey is HNFXXUCMVGIUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H38N4O.C54H36N4O/c1-2-16-39(17-3-1)61-65-62(67-63(66-61)50-25-15-29-55-60(50)49-24-6-11-28-54(49)64(55)52-26-9-4-20-44(52)45-21-5-10-27-53(45)64)42-18-14-19-43(36-42)68-56-30-12-7-22-46(56)47-34-32-41(38-57(47)68)40-33-35-59-51(37-40)48-23-8-13-31-58(48)69-59;1-54(2)45-20-9-6-17-39(45)40-26-24-37(31-46(40)54)53-56-51(33-13-4-3-5-14-33)55-52(57-53)36-15-12-16-38(29-36)58-47-21-10-7-18-41(47)42-27-23-35(32-48(42)58)34-25-28-50-44(30-34)43-19-8-11-22-49(43)59-50/h1-38H;3-32H,1-2H3.
What are the key properties of 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole?
2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole has a molecular weight of 1635.94 g/mol, XLogP of 29.72, 10 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-2-yl-9-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-2-yl-9-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazin-2-yl]phenyl]carbazole is sourced from PubChem (CID 158529955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).