5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran

C52H32O2 — CID 167419865

IUPAC5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran
SMILESc1ccc(-c2ccc(-c3cc(-c4ccccc4)cc(-c4cccc5oc6cccc(-c7cc8oc9ccccc9c8c8ccccc78)c6c45)c3)cc2)cc1
InChIInChI=1S/C52H32O2/c1-3-13-33(14-4-1)35-25-27-36(28-26-35)38-29-37(34-15-5-2-6-16-34)30-39(31-38)40-20-11-23-47-51(40)52-43(21-12-24-48(52)54-47)45-32-49-50(42-18-8-7-17-41(42)45)44-19-9-10-22-46(44)53-49/h1-32H
InChIKeyJMFNCPZVYPYQFH-UHFFFAOYSA-N
MW688.83 g/mol
LogP14.97
Rot. Bonds5

About 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran

5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran (PubChem CID 167419865) has the molecular formula C52H32O2 and a molecular weight of 688.83 g/mol. Its IUPAC name is 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran.

Molecular Properties

Compound Name5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran
PubChem CID167419865
Molecular FormulaC52H32O2
Molecular Weight688.83 g/mol
Exact Mass688.24
IUPAC Name5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran
SMILESc1ccc(-c2ccc(-c3cc(-c4ccccc4)cc(-c4cccc5oc6cccc(-c7cc8oc9ccccc9c8c8ccccc78)c6c45)c3)cc2)cc1
InChIInChI=1S/C52H32O2/c1-3-13-33(14-4-1)35-25-27-36(28-26-35)38-29-37(34-15-5-2-6-16-34)30-39(31-38)40-20-11-23-47-51(40)52-43(21-12-24-48(52)54-47)45-32-49-50(42-18-8-7-17-41(42)45)44-19-9-10-22-46(44)53-49/h1-32H
InChIKeyJMFNCPZVYPYQFH-UHFFFAOYSA-N
XLogP14.97
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500688.83
LogP ≤ 514.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran with MolForge

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Related Compounds

1-[3,5-bis(3-phenylphenyl)phenyl]dibenzofuran
CID 154618828
3-dibenzofuran-1-yl-1-[10-(3,5-diphenylphenyl)anthracen-9-yl]dibenzofuran
CID 167306847
1-(3-dibenzofuran-1-ylphenyl)dibenzofuran
CID 170213719
1-[2-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]phenyl]dibenzofuran
CID 174297045
7-[3-(6-oxobenzo[c]chromen-7-yl)-5-phenylphenyl]benzo[c]chromen-6-one
CID 121242464
1-[3-[3-[3-(3-dibenzofuran-1-ylphenyl)phenyl]phenyl]phenyl]dibenzofuran
CID 90265769
2-(4-dibenzofuran-1-ylphenyl)-4-phenyl-6-[3-[4-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 142425244
2-(3-dibenzofuran-1-ylphenyl)-4-[4-(3-dibenzofuran-1-ylphenyl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 139303458
2,4-bis(4-dibenzofuran-1-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 139304436
2-(5-phenylnaphtho[2,1-b][1]benzofuran-11-yl)-N,N-bis(4-phenylphenyl)aniline
CID 170301670
3-dibenzofuran-4-yl-1-[4-(3-dibenzofuran-1-yl-5-phenylphenyl)naphthalen-1-yl]dibenzofuran
CID 170363981
2-[3-dibenzofuran-1-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 139442533

Frequently Asked Questions

What is the IUPAC name of 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran?
The IUPAC name of 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran (CID 167419865) is 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran.
What is the SMILES notation for 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran?
The canonical SMILES for 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran is c1ccc(-c2ccc(-c3cc(-c4ccccc4)cc(-c4cccc5oc6cccc(-c7cc8oc9ccccc9c8c8ccccc78)c6c45)c3)cc2)cc1.
What is the InChIKey of 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran?
The InChIKey is JMFNCPZVYPYQFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32O2/c1-3-13-33(14-4-1)35-25-27-36(28-26-35)38-29-37(34-15-5-2-6-16-34)30-39(31-38)40-20-11-23-47-51(40)52-43(21-12-24-48(52)54-47)45-32-49-50(42-18-8-7-17-41(42)45)44-19-9-10-22-46(44)53-49/h1-32H.
What are the key properties of 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran?
5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran has a molecular weight of 688.83 g/mol, XLogP of 14.97, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[9-[3-phenyl-5-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]naphtho[2,1-b][1]benzofuran is sourced from PubChem (CID 167419865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).