2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine

C250H184N6O6 — CID 159840364

About 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine

2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine (PubChem CID 159840364) has the molecular formula C250H184N6O6 and a molecular weight of 3368.26 g/mol. Its IUPAC name is 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine.

Molecular Properties

• Compound Name: 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine
• PubChem CID: 159840364
• Molecular Formula: C250H184N6O6
• Molecular Weight: 3368.26 g/mol
• Exact Mass: 3365.43
• IUPAC Name: 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine
• SMILES: Cc1cc(-c2ccc(N(c3c(C)cccc3-c3ccc4oc5ccccc5c4c3)c3cc4ccccc4c4ccccc34)c(C)c2)ccc1N(c1c(C)cccc1-c1ccc2oc3ccccc3c2c1)c1cc2ccccc2c2ccccc12.Cc1cc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3c(C)cccc3-c3ccc4oc5ccccc5c4c3)c(C)c2)ccc1N(c1ccc(-c2ccc(-c3ccccc3)cc2)cc1)c1c(C)cccc1-c1ccc2oc3ccccc3c2c1.Cc1cc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c(C)cccc3-c3ccc4oc5ccccc5c4c3)c(C)c2)ccc1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1c(C)cccc1-c1ccc2oc3ccccc3c2c1
• InChI: InChI=1S/C88H64N2O2.C82H64N2O2.C80H56N2O2/c1-57-17-15-25-75(71-43-51-85-79(55-71)77-23-11-13-27-83(77)91-85)87(57)89(73-45-37-67(38-46-73)65-33-29-63(30-34-65)61-19-7-5-8-20-61)81-49-41-69(53-59(81)3)70-42-50-82(60(4)54-70)90(74-47-39-68(40-48-74)66-35-31-64(32-36-66)62-21-9-6-10-22-62)88-58(2)18-16-26-76(88)72-44-52-86-80(56-72)78-24-12-14-28-84(78)92-86;1-49-19-17-25-59(55-33-41-77-67(45-55)65-23-11-15-29-75(65)85-77)79(49)83(57-35-37-63-61-21-9-13-27-69(61)81(5,6)71(63)47-57)73-39-31-53(43-51(73)3)54-32-40-74(52(4)44-54)84(58-36-38-64-62-22-10-14-28-70(62)82(7,8)72(64)48-58)80-50(2)20-18-26-60(80)56-34-42-78-68(46-56)66-24-12-16-30-76(66)86-78;1-49-19-17-31-61(57-37-41-77-69(45-57)67-29-13-15-33-75(67)83-77)79(49)81(73-47-55-21-5-7-23-59(55)63-25-9-11-27-65(63)73)71-39-35-53(43-51(71)3)54-36-40-72(52(4)44-54)82(74-48-56-22-6-8-24-60(56)64-26-10-12-28-66(64)74)80-50(2)20-18-32-62(80)58-38-42-78-70(46-58)68-30-14-16-34-76(68)84-78/h5-56H,1-4H3;9-48H,1-8H3;5-48H,1-4H3
• InChIKey: NOPGFXFVFJFGNY-UHFFFAOYSA-N
• XLogP: 71.87
• TPSA: 98.28 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 31
• Heavy Atoms: 262
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3368.26
LogP ≤ 5	71.87
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine?

The IUPAC name of 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine (CID 159840364) is 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine.

What is the SMILES notation for 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine?

The canonical SMILES for 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine is Cc1cc(-c2ccc(N(c3c(C)cccc3-c3ccc4oc5ccccc5c4c3)c3cc4ccccc4c4ccccc34)c(C)c2)ccc1N(c1c(C)cccc1-c1ccc2oc3ccccc3c2c1)c1cc2ccccc2c2ccccc12.Cc1cc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3c(C)cccc3-c3ccc4oc5ccccc5c4c3)c(C)c2)ccc1N(c1ccc(-c2ccc(-c3ccccc3)cc2)cc1)c1c(C)cccc1-c1ccc2oc3ccccc3c2c1.Cc1cc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c(C)cccc3-c3ccc4oc5ccccc5c4c3)c(C)c2)ccc1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1c(C)cccc1-c1ccc2oc3ccccc3c2c1.

What is the InChIKey of 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine?

The InChIKey is NOPGFXFVFJFGNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C88H64N2O2.C82H64N2O2.C80H56N2O2/c1-57-17-15-25-75(71-43-51-85-79(55-71)77-23-11-13-27-83(77)91-85)87(57)89(73-45-37-67(38-46-73)65-33-29-63(30-34-65)61-19-7-5-8-20-61)81-49-41-69(53-59(81)3)70-42-50-82(60(4)54-70)90(74-47-39-68(40-48-74)66-35-31-64(32-36-66)62-21-9-6-10-22-62)88-58(2)18-16-26-76(88)72-44-52-86-80(56-72)78-24-12-14-28-84(78)92-86;1-49-19-17-25-59(55-33-41-77-67(45-55)65-23-11-15-29-75(65)85-77)79(49)83(57-35-37-63-61-21-9-13-27-69(61)81(5,6)71(63)47-57)73-39-31-53(43-51(73)3)54-32-40-74(52(4)44-54)84(58-36-38-64-62-22-10-14-28-70(62)82(7,8)72(64)48-58)80-50(2)20-18-26-60(80)56-34-42-78-68(46-56)66-24-12-16-30-76(66)86-78;1-49-19-17-31-61(57-37-41-77-69(45-57)67-29-13-15-33-75(67)83-77)79(49)81(73-47-55-21-5-7-23-59(55)63-25-9-11-27-65(63)73)71-39-35-53(43-51(71)3)54-36-40-72(52(4)44-54)82(74-48-56-22-6-8-24-60(56)64-26-10-12-28-66(64)74)80-50(2)20-18-32-62(80)58-38-42-78-70(46-58)68-30-14-16-34-76(68)84-78/h5-56H,1-4H3;9-48H,1-8H3;5-48H,1-4H3.

What are the key properties of 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine?

2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine has a molecular weight of 3368.26 g/mol, XLogP of 71.87, 31 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 2-dibenzofuran-2-yl-N-[4-[4-[N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-6-methylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-6-methyl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-yl-6-methylphenyl)phenanthren-9-amine is sourced from PubChem (CID 159840364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).