1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole

C58H35NO2 — CID 154970684

IUPAC1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole
SMILESc1ccc2cc(-c3ccc(-c4ccc(-n5c6c(-c7ccc8oc9ccccc9c8c7)cccc6c6cccc(-c7ccc8oc9ccccc9c8c7)c65)cc4)cc3)ccc2c1
InChIInChI=1S/C58H35NO2/c1-2-10-40-33-41(24-23-36(40)9-1)39-21-19-37(20-22-39)38-25-29-44(30-26-38)59-57-45(42-27-31-55-51(34-42)47-11-3-5-17-53(47)60-55)13-7-15-49(57)50-16-8-14-46(58(50)59)43-28-32-56-52(35-43)48-12-4-6-18-54(48)61-56/h1-35H
InChIKeyPYLPNXPUNLWQRQ-UHFFFAOYSA-N
MW777.92 g/mol
LogP16.40
Rot. Bonds5

About 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole

1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole (PubChem CID 154970684) has the molecular formula C58H35NO2 and a molecular weight of 777.92 g/mol. Its IUPAC name is 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole.

Molecular Properties

Compound Name1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole
PubChem CID154970684
Molecular FormulaC58H35NO2
Molecular Weight777.92 g/mol
Exact Mass777.27
IUPAC Name1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole
SMILESc1ccc2cc(-c3ccc(-c4ccc(-n5c6c(-c7ccc8oc9ccccc9c8c7)cccc6c6cccc(-c7ccc8oc9ccccc9c8c7)c65)cc4)cc3)ccc2c1
InChIInChI=1S/C58H35NO2/c1-2-10-40-33-41(24-23-36(40)9-1)39-21-19-37(20-22-39)38-25-29-44(30-26-38)59-57-45(42-27-31-55-51(34-42)47-11-3-5-17-53(47)60-55)13-7-15-49(57)50-16-8-14-46(58(50)59)43-28-32-56-52(35-43)48-12-4-6-18-54(48)61-56/h1-35H
InChIKeyPYLPNXPUNLWQRQ-UHFFFAOYSA-N
XLogP16.40
TPSA31.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500777.92
LogP ≤ 516.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(1,8-diphenylcarbazol-9-yl)phenyl]xanthen-9-one
CID 165377181
3-dibenzofuran-2-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-4-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 163485111
8-dibenzofuran-2-yl-7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)benzo[c]carbazole
CID 142571784
2-(2-dibenzofuran-2-ylphenyl)-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine
CID 172545420
2-[2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran
CID 58536112
2-dibenzofuran-2-yl-4-naphthalen-2-yl-6-(6-naphthalen-2-ylnaphthalen-1-yl)-1,3,5-triazine
CID 170210787
6-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1,9-diphenylcarbazole
CID 155201179
1-[7-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 139342651
19-dibenzofuran-2-yl-21-(4-dibenzofuran-3-yl-6-naphthalen-2-yl-1,3,5-triazin-2-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;ethane
CID 142571760
2-[4-(3-naphthalen-1-yl-10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran
CID 58323246
2-dibenzofuran-2-yl-4-(3-naphthalen-2-ylphenyl)-6-[3-(7-phenylnaphthalen-2-yl)phenyl]-1,3,5-triazine
CID 170942483
2-dibenzofuran-2-yl-4-(8-naphthalen-2-ylnaphthalen-1-yl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 176587677

Frequently Asked Questions

What is the IUPAC name of 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole?
The IUPAC name of 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole (CID 154970684) is 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole.
What is the SMILES notation for 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole?
The canonical SMILES for 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole is c1ccc2cc(-c3ccc(-c4ccc(-n5c6c(-c7ccc8oc9ccccc9c8c7)cccc6c6cccc(-c7ccc8oc9ccccc9c8c7)c65)cc4)cc3)ccc2c1.
What is the InChIKey of 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole?
The InChIKey is PYLPNXPUNLWQRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H35NO2/c1-2-10-40-33-41(24-23-36(40)9-1)39-21-19-37(20-22-39)38-25-29-44(30-26-38)59-57-45(42-27-31-55-51(34-42)47-11-3-5-17-53(47)60-55)13-7-15-49(57)50-16-8-14-46(58(50)59)43-28-32-56-52(35-43)48-12-4-6-18-54(48)61-56/h1-35H.
What are the key properties of 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole?
1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole has a molecular weight of 777.92 g/mol, XLogP of 16.40, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-di(dibenzofuran-2-yl)-9-[4-(4-naphthalen-2-ylphenyl)phenyl]carbazole is sourced from PubChem (CID 154970684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).