9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole

C56H33NO2 — CID 121449285

IUPAC9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole
SMILESc1cc(-c2ccc3oc4ccccc4c3c2)cc(-n2c3ccccc3c3cc(-c4ccc5oc6c(-c7cc8ccccc8c8ccccc78)cccc6c5c4)ccc32)c1
InChIInChI=1S/C56H33NO2/c1-2-14-40-38(11-1)33-47(42-16-4-3-15-41(40)42)45-19-10-20-46-50-32-37(25-28-55(50)59-56(45)46)35-23-26-52-48(30-35)43-17-5-7-21-51(43)57(52)39-13-9-12-34(29-39)36-24-27-54-49(31-36)44-18-6-8-22-53(44)58-54/h1-33H
InChIKeyPQBBXNQGGSLKCB-UHFFFAOYSA-N
MW751.89 g/mol
LogP15.89
Rot. Bonds4

About 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole

9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole (PubChem CID 121449285) has the molecular formula C56H33NO2 and a molecular weight of 751.89 g/mol. Its IUPAC name is 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole.

Molecular Properties

Compound Name9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole
PubChem CID121449285
Molecular FormulaC56H33NO2
Molecular Weight751.89 g/mol
Exact Mass751.25
IUPAC Name9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole
SMILESc1cc(-c2ccc3oc4ccccc4c3c2)cc(-n2c3ccccc3c3cc(-c4ccc5oc6c(-c7cc8ccccc8c8ccccc78)cccc6c5c4)ccc32)c1
InChIInChI=1S/C56H33NO2/c1-2-14-40-38(11-1)33-47(42-16-4-3-15-41(40)42)45-19-10-20-46-50-32-37(25-28-55(50)59-56(45)46)35-23-26-52-48(30-35)43-17-5-7-21-51(43)57(52)39-13-9-12-34(29-39)36-24-27-54-49(31-36)44-18-6-8-22-53(44)58-54/h1-33H
InChIKeyPQBBXNQGGSLKCB-UHFFFAOYSA-N
XLogP15.89
TPSA31.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500751.89
LogP ≤ 515.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole 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

9-(6-dibenzofuran-4-yldibenzofuran-2-yl)-3-phenylcarbazole
CID 146532981
9-[3-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]-3-dibenzofuran-4-ylcarbazole
CID 58099745
3-dibenzofuran-4-yl-9-(3-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 121449361
3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-naphthalen-2-ylcarbazole
CID 155305912
3-[8-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 137474197
3-(3-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 137466609
3-dibenzofuran-2-yl-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 121449395
3-(3-carbazol-9-ylphenyl)-9-phenylcarbazole;9-(3-dibenzofuran-2-ylphenyl)carbazole
CID 158532240
9-[3-[10-(3-dibenzofuran-4-ylphenyl)anthracen-9-yl]phenyl]carbazole;9-[3-[10-(4-dibenzofuran-4-ylphenyl)anthracen-9-yl]phenyl]carbazole;3-[3-[10-(3-dibenzofuran-2-ylphenyl)anthracen-9-yl]phenyl]-9-phenylcarbazole
CID 158195291
3-dibenzofuran-4-yl-9-[4-[8-(3-dibenzofuran-4-ylcarbazol-9-yl)dibenzofuran-2-yl]phenyl]carbazole
CID 121449462
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 134313296
3-dibenzofuran-4-yl-9-[3-(3-dibenzofuran-4-ylcarbazol-9-yl)phenyl]carbazole
CID 71004884

Frequently Asked Questions

What is the IUPAC name of 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole?
The IUPAC name of 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole (CID 121449285) is 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole.
What is the SMILES notation for 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole?
The canonical SMILES for 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole is c1cc(-c2ccc3oc4ccccc4c3c2)cc(-n2c3ccccc3c3cc(-c4ccc5oc6c(-c7cc8ccccc8c8ccccc78)cccc6c5c4)ccc32)c1.
What is the InChIKey of 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole?
The InChIKey is PQBBXNQGGSLKCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H33NO2/c1-2-14-40-38(11-1)33-47(42-16-4-3-15-41(40)42)45-19-10-20-46-50-32-37(25-28-55(50)59-56(45)46)35-23-26-52-48(30-35)43-17-5-7-21-51(43)57(52)39-13-9-12-34(29-39)36-24-27-54-49(31-36)44-18-6-8-22-53(44)58-54/h1-33H.
What are the key properties of 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole?
9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole has a molecular weight of 751.89 g/mol, XLogP of 15.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-dibenzofuran-2-ylphenyl)-3-(6-phenanthren-9-yldibenzofuran-2-yl)carbazole is sourced from PubChem (CID 121449285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).