10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline

C35H21NO — CID 59183399

IUPAC10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline
SMILESc1ccc2c(-c3c4ccccc4c(-c4cccc5c4oc4ccccc45)c4cnccc34)cccc2c1
InChIInChI=1S/C35H21NO/c1-2-11-23-22(9-1)10-7-15-25(23)33-26-13-3-4-14-27(26)34(31-21-36-20-19-28(31)33)30-17-8-16-29-24-12-5-6-18-32(24)37-35(29)30/h1-21H
InChIKeyFOWWFFMJNGQGQR-UHFFFAOYSA-N
MW471.56 g/mol
LogP9.77
Rot. Bonds2

About 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline

10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline (PubChem CID 59183399) has the molecular formula C35H21NO and a molecular weight of 471.56 g/mol. Its IUPAC name is 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline.

Molecular Properties

Compound Name10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline
PubChem CID59183399
Molecular FormulaC35H21NO
Molecular Weight471.56 g/mol
Exact Mass471.16
IUPAC Name10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline
SMILESc1ccc2c(-c3c4ccccc4c(-c4cccc5c4oc4ccccc45)c4cnccc34)cccc2c1
InChIInChI=1S/C35H21NO/c1-2-11-23-22(9-1)10-7-15-25(23)33-26-13-3-4-14-27(26)34(31-21-36-20-19-28(31)33)30-17-8-16-29-24-12-5-6-18-32(24)37-35(29)30/h1-21H
InChIKeyFOWWFFMJNGQGQR-UHFFFAOYSA-N
XLogP9.77
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.56
LogP ≤ 59.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline
CID 59184089
4-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)dibenzofuran
CID 153436636
5-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran
CID 88568856
10-fluoranthen-3-yl-5-naphthalen-1-ylbenzo[g]isoquinoline
CID 59183762
4-anthracen-9-yldibenzofuran
CID 167187282
4-(4-dibenzofuran-4-ylanthracen-9-yl)dibenzofuran
CID 88910037
4-[10-[6-(3-phenylphenyl)naphthalen-1-yl]anthracen-9-yl]dibenzofuran
CID 164758444
2-(10-dibenzofuran-4-ylanthracen-9-yl)benzo[g][1]benzofuran
CID 174306733
2-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;4-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]dibenzofuran
CID 158628764
2-dibenzofuran-4-yl-4-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-6-(2-phenylphenyl)-1,3,5-triazine
CID 139442183
4-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;4-(10-naphthalen-2-ylanthracen-9-yl)dibenzofuran;4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzofuran;4-(10-phenylanthracen-9-yl)dibenzofuran;4-[10-(4-phenylphenyl)anthracen-9-yl]dibenzofuran
CID 158958080
4-[3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran
CID 58536066

Frequently Asked Questions

What is the IUPAC name of 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline?
The IUPAC name of 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline (CID 59183399) is 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline.
What is the SMILES notation for 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline?
The canonical SMILES for 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline is c1ccc2c(-c3c4ccccc4c(-c4cccc5c4oc4ccccc45)c4cnccc34)cccc2c1.
What is the InChIKey of 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline?
The InChIKey is FOWWFFMJNGQGQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H21NO/c1-2-11-23-22(9-1)10-7-15-25(23)33-26-13-3-4-14-27(26)34(31-21-36-20-19-28(31)33)30-17-8-16-29-24-12-5-6-18-32(24)37-35(29)30/h1-21H.
What are the key properties of 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline?
10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline has a molecular weight of 471.56 g/mol, XLogP of 9.77, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline is sourced from PubChem (CID 59183399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).