2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole

C54H35NO — CID 122492307

IUPAC2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
SMILESc1ccc(-c2cccc(-c3cc(-c4ccc5c6ccccc6n(-c6cccc(-c7ccccc7)c6)c5c4)cc(-c4cccc5c4oc4ccccc45)c3)c2)cc1
InChIInChI=1S/C54H35NO/c1-3-14-36(15-4-1)38-18-11-19-39(30-38)42-31-43(33-44(32-42)46-24-13-25-50-49-23-8-10-27-53(49)56-54(46)50)41-28-29-48-47-22-7-9-26-51(47)55(52(48)35-41)45-21-12-20-40(34-45)37-16-5-2-6-17-37/h1-35H
InChIKeyQVPAQYNMGOWPHF-UHFFFAOYSA-N
MW713.88 g/mol
LogP15.02
Rot. Bonds6

About 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole

2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole (PubChem CID 122492307) has the molecular formula C54H35NO and a molecular weight of 713.88 g/mol. Its IUPAC name is 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole.

Molecular Properties

Compound Name2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
PubChem CID122492307
Molecular FormulaC54H35NO
Molecular Weight713.88 g/mol
Exact Mass713.27
IUPAC Name2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
SMILESc1ccc(-c2cccc(-c3cc(-c4ccc5c6ccccc6n(-c6cccc(-c7ccccc7)c6)c5c4)cc(-c4cccc5c4oc4ccccc45)c3)c2)cc1
InChIInChI=1S/C54H35NO/c1-3-14-36(15-4-1)38-18-11-19-39(30-38)42-31-43(33-44(32-42)46-24-13-25-50-49-23-8-10-27-53(49)56-54(46)50)41-28-29-48-47-22-7-9-26-51(47)55(52(48)35-41)45-21-12-20-40(34-45)37-16-5-2-6-17-37/h1-35H
InChIKeyQVPAQYNMGOWPHF-UHFFFAOYSA-N
XLogP15.02
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500713.88
LogP ≤ 515.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-phenylcarbazole
CID 122492294
2-[9-[3-(3-dibenzofuran-4-ylphenyl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 166509994
2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole
CID 87156606
11-(4-dibenzofuran-4-ylphenyl)-3,5-diphenylindolo[3,2-b]carbazole
CID 126580169
9-(6-dibenzofuran-4-yldibenzofuran-3-yl)-2-phenylcarbazole
CID 170285075
3-dibenzofuran-4-yl-N-phenyl-5-(9-phenylcarbazol-2-yl)-N-(4-phenylphenyl)aniline
CID 121443723
9-[3-[8-[3-[3-(4-phenylphenyl)phenyl]phenyl]dibenzofuran-4-yl]phenyl]carbazole
CID 118438864
N-[4-(3-carbazol-9-ylphenyl)phenyl]-4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-N-[4-[3-(3-phenylphenyl)phenyl]phenyl]aniline
CID 88862471
N-(4-dibenzofuran-4-ylphenyl)-3-phenyl-5-(9-phenylcarbazol-2-yl)-N-(4-phenylphenyl)aniline
CID 118640922
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 134313296
5-(3-dibenzofuran-4-ylphenyl)-7-(4-phenylphenyl)indolo[2,3-b]carbazole
CID 171414718
2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-6-phenyl-9-(3-phenylphenyl)carbazole;2-[3-dibenzoselenophen-4-yl-5-(3-phenylphenyl)phenyl]-9-phenylcarbazole;2-[3-dibenzoselenophen-4-yl-5-(4-phenylphenyl)phenyl]-9-phenylcarbazole
CID 159081606

Frequently Asked Questions

What is the IUPAC name of 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole?
The IUPAC name of 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole (CID 122492307) is 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole.
What is the SMILES notation for 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole?
The canonical SMILES for 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole is c1ccc(-c2cccc(-c3cc(-c4ccc5c6ccccc6n(-c6cccc(-c7ccccc7)c6)c5c4)cc(-c4cccc5c4oc4ccccc45)c3)c2)cc1.
What is the InChIKey of 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole?
The InChIKey is QVPAQYNMGOWPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H35NO/c1-3-14-36(15-4-1)38-18-11-19-39(30-38)42-31-43(33-44(32-42)46-24-13-25-50-49-23-8-10-27-53(49)56-54(46)50)41-28-29-48-47-22-7-9-26-51(47)55(52(48)35-41)45-21-12-20-40(34-45)37-16-5-2-6-17-37/h1-35H.
What are the key properties of 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole?
2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole has a molecular weight of 713.88 g/mol, XLogP of 15.02, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole is sourced from PubChem (CID 122492307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).