9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole

C66H44N2 — CID 58943784

IUPAC9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C66H44N2/c1-4-18-45(19-5-1)51-43-60(46-20-6-2-7-21-46)66(61(44-51)47-22-8-3-9-23-47)50-36-41-54(48-32-37-52(38-33-48)67-62-28-14-10-24-55(62)56-25-11-15-29-63(56)67)59(42-50)49-34-39-53(40-35-49)68-64-30-16-12-26-57(64)58-27-13-17-31-65(58)68/h1-44H
InChIKeyHZVKLHYOLBOTPV-UHFFFAOYSA-N
MW865.09 g/mol
LogP17.88
Rot. Bonds8

About 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole

9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole (PubChem CID 58943784) has the molecular formula C66H44N2 and a molecular weight of 865.09 g/mol. Its IUPAC name is 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole
PubChem CID58943784
Molecular FormulaC66H44N2
Molecular Weight865.09 g/mol
Exact Mass864.35
IUPAC Name9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C66H44N2/c1-4-18-45(19-5-1)51-43-60(46-20-6-2-7-21-46)66(61(44-51)47-22-8-3-9-23-47)50-36-41-54(48-32-37-52(38-33-48)67-62-28-14-10-24-55(62)56-25-11-15-29-63(56)67)59(42-50)49-34-39-53(40-35-49)68-64-30-16-12-26-57(64)58-27-13-17-31-65(58)68/h1-44H
InChIKeyHZVKLHYOLBOTPV-UHFFFAOYSA-N
XLogP17.88
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500865.09
LogP ≤ 517.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,5-diphenylphenyl)phenyl]phenyl]carbazole
CID 58943802
9-[4-[4-(4-carbazol-9-ylphenyl)-2-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 58879507
9-[4-[2-(4-carbazol-9-ylphenyl)-4-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 58943813
9-[4-[3-(4-carbazol-9-ylphenyl)-4-(2,4,5-triphenylphenyl)phenyl]phenyl]carbazole
CID 58943753
3-[9-[3-[3-[4-(3,5-dimethylphenyl)phenyl]-4,5-diphenylphenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[3-(3,5-dimethylphenyl)phenyl]-3-phenylphenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[3-(3,5-dimethylphenyl)-5-phenylphenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[5-(3,5-dimethylphenyl)-2-phenylphenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 158255818
3-carbazol-9-yl-9-[3-(2,5-diphenylphenyl)-4-phenylphenyl]carbazole
CID 146872026
3-[9-[3-(2,4-diphenylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 144560233
3-carbazol-9-yl-9-[4-(2,4,5-triphenylphenyl)phenyl]carbazole
CID 152852425
9-[4-(3,5-diphenylphenyl)phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118231210
9-[4-[3-(3,5-diphenylphenyl)phenyl]phenyl]carbazole
CID 118595106
9-[4-[3-[3-(4-carbazol-9-ylphenyl)-5-phenylphenyl]phenyl]phenyl]carbazole;9-[4-[3-[3-(4-carbazol-9-ylphenyl)-5-phenylphenyl]-5-phenylphenyl]phenyl]carbazole
CID 159046230
3-carbazol-9-yl-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 149208011

Frequently Asked Questions

What is the IUPAC name of 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole?
The IUPAC name of 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole (CID 58943784) is 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole?
The canonical SMILES for 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole is c1ccc(-c2cc(-c3ccccc3)c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3)c(-c3ccccc3)c2)cc1.
What is the InChIKey of 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole?
The InChIKey is HZVKLHYOLBOTPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H44N2/c1-4-18-45(19-5-1)51-43-60(46-20-6-2-7-21-46)66(61(44-51)47-22-8-3-9-23-47)50-36-41-54(48-32-37-52(38-33-48)67-62-28-14-10-24-55(62)56-25-11-15-29-63(56)67)59(42-50)49-34-39-53(40-35-49)68-64-30-16-12-26-57(64)58-27-13-17-31-65(58)68/h1-44H.
What are the key properties of 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole?
9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole has a molecular weight of 865.09 g/mol, XLogP of 17.88, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole is sourced from PubChem (CID 58943784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).