1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran

C44H28O — CID 134169518

IUPAC1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran
SMILESc1ccc(-c2ccccc2-c2cccc3c2oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)cc1
InChIInChI=1S/C44H28O/c1-3-15-29(16-4-1)31-19-7-8-20-32(31)37-25-13-27-39-43-38(26-14-28-40(43)45-44(37)39)42-35-23-11-9-21-33(35)41(30-17-5-2-6-18-30)34-22-10-12-24-36(34)42/h1-28H
InChIKeyBQCKRIZODXOGRO-UHFFFAOYSA-N
MW572.71 g/mol
LogP12.56
Rot. Bonds4

About 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran

1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran (PubChem CID 134169518) has the molecular formula C44H28O and a molecular weight of 572.71 g/mol. Its IUPAC name is 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran.

Molecular Properties

Compound Name1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran
PubChem CID134169518
Molecular FormulaC44H28O
Molecular Weight572.71 g/mol
Exact Mass572.21
IUPAC Name1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran
SMILESc1ccc(-c2ccccc2-c2cccc3c2oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)cc1
InChIInChI=1S/C44H28O/c1-3-15-29(16-4-1)31-19-7-8-20-32(31)37-25-13-27-39-43-38(26-14-28-40(43)45-44(37)39)42-35-23-11-9-21-33(35)41(30-17-5-2-6-18-30)34-22-10-12-24-36(34)42/h1-28H
InChIKeyBQCKRIZODXOGRO-UHFFFAOYSA-N
XLogP12.56
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500572.71
LogP ≤ 512.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[10-[4-(2-dibenzofuran-4-ylphenyl)phenyl]anthracen-9-yl]dibenzofuran
CID 174297149
1-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]-6-phenyldibenzofuran
CID 176751774
1-[10-(3,5-diphenylphenyl)anthracen-9-yl]-6-phenyldibenzofuran
CID 176777662
6,8-diphenyl-1-[10-(4-phenylphenyl)anthracen-9-yl]dibenzofuran
CID 170205377
1,6-diphenyldibenzofuran
CID 145331756
7-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 130185376
7-[10-[4-(2-naphthalen-1-ylphenyl)phenyl]anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 174272834
1-phenyl-6-[10-[5-[6-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphthalen-2-yl]anthracen-9-yl]dibenzofuran
CID 175617518
7-(10-dibenzofuran-4-ylanthracen-9-yl)-16-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaene
CID 153314459
4-[4-[10-(4-dibenzofuran-1-ylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]-1-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran
CID 154970869
1-(10-phenylanthracen-9-yl)-8-[2-(4-phenylphenyl)phenyl]dibenzofuran
CID 134471897
4-naphthalen-1-yl-1-(10-phenylanthracen-9-yl)dibenzofuran
CID 138749852

Frequently Asked Questions

What is the IUPAC name of 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran?
The IUPAC name of 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran (CID 134169518) is 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran.
What is the SMILES notation for 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran?
The canonical SMILES for 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran is c1ccc(-c2ccccc2-c2cccc3c2oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)cc1.
What is the InChIKey of 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran?
The InChIKey is BQCKRIZODXOGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28O/c1-3-15-29(16-4-1)31-19-7-8-20-32(31)37-25-13-27-39-43-38(26-14-28-40(43)45-44(37)39)42-35-23-11-9-21-33(35)41(30-17-5-2-6-18-30)34-22-10-12-24-36(34)42/h1-28H.
What are the key properties of 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran?
1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran has a molecular weight of 572.71 g/mol, XLogP of 12.56, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(10-phenylanthracen-9-yl)-6-(2-phenylphenyl)dibenzofuran is sourced from PubChem (CID 134169518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).