N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline

C134H88N4O2 — CID 159572634

About N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline

N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline (PubChem CID 159572634) has the molecular formula C134H88N4O2 and a molecular weight of 1786.20 g/mol. Its IUPAC name is N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline.

Molecular Properties

• Compound Name: N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline
• PubChem CID: 159572634
• Molecular Formula: C134H88N4O2
• Molecular Weight: 1786.20 g/mol
• Exact Mass: 1784.69
• IUPAC Name: N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline
• SMILES: c1ccc(-c2ccccc2-c2ccccc2N(c2ccc(-c3ccccc3-c3ccccc3-n3c4ccccc4c4ccccc43)cc2)c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc(-c2ccccc2-n2c3ccccc3c3ccccc32)c(-c2ccc(N(c3ccc(-c4ccc5c(ccc6ccccc65)c4)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)c1
• InChI: InChI=1S/C68H44N2O.C66H44N2O/c1-2-15-54-46(14-1)28-29-50-44-49(36-43-56(50)54)45-30-37-51(38-31-45)69(53-41-34-48(35-42-53)57-22-13-23-63-62-21-8-12-27-67(62)71-68(57)63)52-39-32-47(33-40-52)55-16-3-4-17-58(55)59-18-5-9-24-64(59)70-65-25-10-6-19-60(65)61-20-7-11-26-66(61)70;1-2-19-45(20-3-1)50-21-4-6-23-53(50)55-25-8-13-32-61(55)67(49-43-39-47(40-44-49)52-30-18-31-60-59-29-12-17-36-65(59)69-66(52)60)48-41-37-46(38-42-48)51-22-5-7-24-54(51)56-26-9-14-33-62(56)68-63-34-15-10-27-57(63)58-28-11-16-35-64(58)68/h1-44H;1-44H
• InChIKey: MHZYBRUAKPXUJJ-UHFFFAOYSA-N
• XLogP: 37.62
• TPSA: 42.62 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 17
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1786.20
LogP ≤ 5	37.62
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline?

The IUPAC name of N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline (CID 159572634) is N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline.

What is the SMILES notation for N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline?

The canonical SMILES for N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline is c1ccc(-c2ccccc2-c2ccccc2N(c2ccc(-c3ccccc3-c3ccccc3-n3c4ccccc4c4ccccc43)cc2)c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc(-c2ccccc2-n2c3ccccc3c3ccccc32)c(-c2ccc(N(c3ccc(-c4ccc5c(ccc6ccccc65)c4)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)c1.

What is the InChIKey of N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline?

The InChIKey is MHZYBRUAKPXUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H44N2O.C66H44N2O/c1-2-15-54-46(14-1)28-29-50-44-49(36-43-56(50)54)45-30-37-51(38-31-45)69(53-41-34-48(35-42-53)57-22-13-23-63-62-21-8-12-27-67(62)71-68(57)63)52-39-32-47(33-40-52)55-16-3-4-17-58(55)59-18-5-9-24-64(59)70-65-25-10-6-19-60(65)61-20-7-11-26-66(61)70;1-2-19-45(20-3-1)50-21-4-6-23-53(50)55-25-8-13-32-61(55)67(49-43-39-47(40-44-49)52-30-18-31-60-59-29-12-17-36-65(59)69-66(52)60)48-41-37-46(38-42-48)51-22-5-7-24-54(51)56-26-9-14-33-62(56)68-63-34-15-10-27-57(63)58-28-11-16-35-64(58)68/h1-44H;1-44H.

What are the key properties of N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline?

N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline has a molecular weight of 1786.20 g/mol, XLogP of 37.62, 17 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline is sourced from PubChem (CID 159572634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).