N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine

C82H53N7O — CID 126632796

IUPACN-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4nc(-c5ccc6ccc(N(c7ccccc7)c7ccc8c9ccccc9n(-c9ccccc9)c8c7)cc6c5)nc(-n5c6ccccc6c6cc(-c7ccc8oc9ccccc9c8c7)ccc65)n4)c3cc21
InChIInChI=1S/C82H53N7O/c1-82(2)69-28-14-9-23-59(69)65-48-67-62-26-12-17-31-73(62)89(76(67)49-70(65)82)81-84-79(83-80(85-81)88-72-30-16-11-25-61(72)66-45-51(36-41-74(66)88)52-37-42-78-68(46-52)64-27-13-18-32-77(64)90-78)53-34-33-50-35-38-57(44-54(50)43-53)86(55-19-5-3-6-20-55)58-39-40-63-60-24-10-15-29-71(60)87(75(63)47-58)56-21-7-4-8-22-56/h3-49H,1-2H3
InChIKeyQWUZWINOHSEXEM-UHFFFAOYSA-N
MW1152.37 g/mol
LogP21.33
Rot. Bonds8

About N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine

N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine (PubChem CID 126632796) has the molecular formula C82H53N7O and a molecular weight of 1152.37 g/mol. Its IUPAC name is N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine.

Molecular Properties

Compound NameN-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine
PubChem CID126632796
Molecular FormulaC82H53N7O
Molecular Weight1152.37 g/mol
Exact Mass1151.43
IUPAC NameN-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4nc(-c5ccc6ccc(N(c7ccccc7)c7ccc8c9ccccc9n(-c9ccccc9)c8c7)cc6c5)nc(-n5c6ccccc6c6cc(-c7ccc8oc9ccccc9c8c7)ccc65)n4)c3cc21
InChIInChI=1S/C82H53N7O/c1-82(2)69-28-14-9-23-59(69)65-48-67-62-26-12-17-31-73(62)89(76(67)49-70(65)82)81-84-79(83-80(85-81)88-72-30-16-11-25-61(72)66-45-51(36-41-74(66)88)52-37-42-78-68(46-52)64-27-13-18-32-77(64)90-78)53-34-33-50-35-38-57(44-54(50)43-53)86(55-19-5-3-6-20-55)58-39-40-63-60-24-10-15-29-71(60)87(75(63)47-58)56-21-7-4-8-22-56/h3-49H,1-2H3
InChIKeyQWUZWINOHSEXEM-UHFFFAOYSA-N
XLogP21.33
TPSA69.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms90
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001152.37
LogP ≤ 521.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine with MolForge

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Related Compounds

5-[4-[6-[2,7-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-2-yl]-6-(3-dibenzofuran-2-ylcarbazol-9-yl)-1,3,5-triazin-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 126632809
5-[4-[3,6-bis(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-6-(3-dibenzofuran-2-ylcarbazol-9-yl)-1,3,5-triazin-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 126632822
N-[4-[7-[7-[4-[4-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 139504991
5-[4-dibenzofuran-3-yl-6-(3-phenylcarbazol-9-yl)-1,3,5-triazin-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 169014138
7-carbazol-9-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-carbazol-9-yl-N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3,5-diphenylphenyl)phenyl]-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 159213224
N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-7-(9-phenylcarbazol-2-yl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 89213188
N-[4-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-N-(9,9'-spirobi[fluorene]-3-yl)dibenzofuran-3-amine
CID 126702849
7-carbazol-9-yl-N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 89213172
N-[4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]phenyl]-9,9-dimethyl-N,7-diphenylfluoren-2-amine;N-[4-[4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]phenyl]phenyl]-9,9-dimethyl-N,7-diphenylfluoren-2-amine;9,9-dimethyl-N,7-diphenyl-N-[4-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]fluoren-2-amine
CID 158113731
N-(4-carbazol-9-ylphenyl)-4-dibenzofuran-2-yl-N-[4-(3,5-diphenylphenyl)phenyl]aniline;N-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)-4-naphthalen-2-ylaniline;4-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-2-ylphenyl)-4-methylaniline
CID 162052470
4-[4-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]-N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 66585298
5-(4-carbazol-9-yl-6-dibenzofuran-3-yl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazole
CID 166914017

Frequently Asked Questions

What is the IUPAC name of N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine?
The IUPAC name of N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine (CID 126632796) is N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine.
What is the SMILES notation for N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine?
The canonical SMILES for N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine is CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4nc(-c5ccc6ccc(N(c7ccccc7)c7ccc8c9ccccc9n(-c9ccccc9)c8c7)cc6c5)nc(-n5c6ccccc6c6cc(-c7ccc8oc9ccccc9c8c7)ccc65)n4)c3cc21.
What is the InChIKey of N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine?
The InChIKey is QWUZWINOHSEXEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C82H53N7O/c1-82(2)69-28-14-9-23-59(69)65-48-67-62-26-12-17-31-73(62)89(76(67)49-70(65)82)81-84-79(83-80(85-81)88-72-30-16-11-25-61(72)66-45-51(36-41-74(66)88)52-37-42-78-68(46-52)64-27-13-18-32-77(64)90-78)53-34-33-50-35-38-57(44-54(50)43-53)86(55-19-5-3-6-20-55)58-39-40-63-60-24-10-15-29-71(60)87(75(63)47-58)56-21-7-4-8-22-56/h3-49H,1-2H3.
What are the key properties of N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine?
N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine has a molecular weight of 1152.37 g/mol, XLogP of 21.33, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)-6-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-N,9-diphenylcarbazol-2-amine is sourced from PubChem (CID 126632796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).