9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole

C56H36N2 — CID 58971525

IUPAC9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole
SMILESc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3cc(-c4ccc5cc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)ccc5c4)ccc3c2)cc1
InChIInChI=1S/C56H36N2/c1-5-13-53-49(9-1)50-10-2-6-14-54(50)57(53)47-29-25-37(26-30-47)39-17-19-43-35-45(23-21-41(43)33-39)46-24-22-42-34-40(18-20-44(42)36-46)38-27-31-48(32-28-38)58-55-15-7-3-11-51(55)52-12-4-8-16-56(52)58/h1-36H
InChIKeyBATCUOVDQWXENN-UHFFFAOYSA-N
MW736.92 g/mol
LogP15.19
Rot. Bonds5

About 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole

9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole (PubChem CID 58971525) has the molecular formula C56H36N2 and a molecular weight of 736.92 g/mol. Its IUPAC name is 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole
PubChem CID58971525
Molecular FormulaC56H36N2
Molecular Weight736.92 g/mol
Exact Mass736.29
IUPAC Name9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole
SMILESc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3cc(-c4ccc5cc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)ccc5c4)ccc3c2)cc1
InChIInChI=1S/C56H36N2/c1-5-13-53-49(9-1)50-10-2-6-14-54(50)57(53)47-29-25-37(26-30-47)39-17-19-43-35-45(23-21-41(43)33-39)46-24-22-42-34-40(18-20-44(42)36-46)38-27-31-48(32-28-38)58-55-15-7-3-11-51(55)52-12-4-8-16-56(52)58/h1-36H
InChIKeyBATCUOVDQWXENN-UHFFFAOYSA-N
XLogP15.19
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500736.92
LogP ≤ 515.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[4-(6-phenylnaphthalen-2-yl)phenyl]carbazole
CID 58971457
9-[4-[6-(4-carbazol-9-ylphenyl)anthracen-2-yl]phenyl]carbazole
CID 58690855
6-(4-carbazol-9-ylphenyl)naphthalen-2-ol
CID 58460617
3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 118231204
9-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041201
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 135323607
N-(4-carbazol-9-ylphenyl)-N-[4-(6-phenylnaphthalen-2-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 146580367
3-(9-phenylcarbazol-3-yl)-9-(6-phenylnaphthalen-2-yl)carbazole
CID 118581886
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline
CID 146579381
9-[4-[6-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]naphthalen-2-yl]phenyl]carbazole
CID 58971465
9-(4-pyren-2-ylphenyl)carbazole
CID 58273485
3-[4-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]phenyl]-9-phenylcarbazole
CID 126764142

Frequently Asked Questions

What is the IUPAC name of 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole?
The IUPAC name of 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole (CID 58971525) is 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole?
The canonical SMILES for 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole is c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3cc(-c4ccc5cc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)ccc5c4)ccc3c2)cc1.
What is the InChIKey of 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole?
The InChIKey is BATCUOVDQWXENN-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36N2/c1-5-13-53-49(9-1)50-10-2-6-14-54(50)57(53)47-29-25-37(26-30-47)39-17-19-43-35-45(23-21-41(43)33-39)46-24-22-42-34-40(18-20-44(42)36-46)38-27-31-48(32-28-38)58-55-15-7-3-11-51(55)52-12-4-8-16-56(52)58/h1-36H.
What are the key properties of 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole?
9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole has a molecular weight of 736.92 g/mol, XLogP of 15.19, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole is sourced from PubChem (CID 58971525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).