1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine

C341H286N24O2 — CID 159029293

About 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine

1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine (PubChem CID 159029293) has the molecular formula C341H286N24O2 and a molecular weight of 4752.20 g/mol. Its IUPAC name is 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine.

Molecular Properties

• Compound Name: 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine
• PubChem CID: 159029293
• Molecular Formula: C341H286N24O2
• Molecular Weight: 4752.20 g/mol
• Exact Mass: 4748.30
• IUPAC Name: 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine
• SMILES: CCOc1cccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccc(N(c5ccccc5)c5cccc(OCC)c5)cc4)cc3)cc2)c1.Cc1ccc(N(c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2cccc(N(c3ccc(C)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2)cc1.Cc1ccc(N(c2ccccc2)c2ccc(N(c3ccc(C)cc3)c3cccc(N(c4ccc(C)cc4)c4ccc(N(c5ccccc5)c5ccc(C)cc5)cc4)c3)cc2)cc1.Cc1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3cccc(N(c4ccccc4)c4ccc(N(c5ccccc5)c5ccc(C)c(C)c5)cc4)c3)cc2)cc1C.Cc1cccc(N(c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2cccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2)c1.Cc1cccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3cccc(N(c4ccccc4)c4ccc(N(c5ccccc5)c5cccc(C)c5)cc4)c3)cc2)c1
• InChI: InChI=1S/C58H50N4O2.2C58H50N4.2C56H46N4.C55H44N4/c1-3-63-57-29-17-27-55(43-57)61(47-23-13-7-14-24-47)53-39-35-51(36-40-53)59(45-19-9-5-10-20-45)49-31-33-50(34-32-49)60(46-21-11-6-12-22-46)52-37-41-54(42-38-52)62(48-25-15-8-16-26-48)56-28-18-30-58(44-56)64-4-2;1-43-28-30-57(40-45(43)3)61(49-22-13-7-14-23-49)53-36-32-51(33-37-53)59(47-18-9-5-10-19-47)55-26-17-27-56(42-55)60(48-20-11-6-12-21-48)52-34-38-54(39-35-52)62(50-24-15-8-16-25-50)58-31-29-44(2)46(4)41-58;1-43-18-26-49(27-19-43)59(47-12-7-5-8-13-47)53-34-38-55(39-35-53)61(51-30-22-45(3)23-31-51)57-16-11-17-58(42-57)62(52-32-24-46(4)25-33-52)56-40-36-54(37-41-56)60(48-14-9-6-10-15-48)50-28-20-44(2)21-29-50;1-43-18-15-28-53(40-43)57(45-20-7-3-8-21-45)49-32-36-51(37-33-49)59(47-24-11-5-12-25-47)55-30-17-31-56(42-55)60(48-26-13-6-14-27-48)52-38-34-50(35-39-52)58(46-22-9-4-10-23-46)54-29-16-19-44(2)41-54;1-43-26-30-49(31-27-43)59(53-38-34-51(35-39-53)57(45-16-7-3-8-17-45)46-18-9-4-10-19-46)55-24-15-25-56(42-55)60(50-32-28-44(2)29-33-50)54-40-36-52(37-41-54)58(47-20-11-5-12-21-47)48-22-13-6-14-23-48;1-43-19-17-30-53(41-43)59(52-39-35-50(36-40-52)57(46-24-11-4-12-25-46)47-26-13-5-14-27-47)55-32-18-31-54(42-55)58(48-28-15-6-16-29-48)51-37-33-49(34-38-51)56(44-20-7-2-8-21-44)45-22-9-3-10-23-45/h5-44H,3-4H2,1-2H3;2*5-42H,1-4H3;2*3-42H,1-2H3;2-42H,1H3
• InChIKey: JURDAMCAVLRLBA-UHFFFAOYSA-N
• XLogP: 98.20
• TPSA: 96.22 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 76
• Heavy Atoms: 367
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4752.20
LogP ≤ 5	98.20
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine?

The IUPAC name of 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine (CID 159029293) is 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine.

What is the SMILES notation for 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine?

The canonical SMILES for 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine is CCOc1cccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccc(N(c5ccccc5)c5cccc(OCC)c5)cc4)cc3)cc2)c1.Cc1ccc(N(c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2cccc(N(c3ccc(C)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2)cc1.Cc1ccc(N(c2ccccc2)c2ccc(N(c3ccc(C)cc3)c3cccc(N(c4ccc(C)cc4)c4ccc(N(c5ccccc5)c5ccc(C)cc5)cc4)c3)cc2)cc1.Cc1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3cccc(N(c4ccccc4)c4ccc(N(c5ccccc5)c5ccc(C)c(C)c5)cc4)c3)cc2)cc1C.Cc1cccc(N(c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2cccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2)c1.Cc1cccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3cccc(N(c4ccccc4)c4ccc(N(c5ccccc5)c5cccc(C)c5)cc4)c3)cc2)c1.

What is the InChIKey of 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine?

The InChIKey is JURDAMCAVLRLBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H50N4O2.2C58H50N4.2C56H46N4.C55H44N4/c1-3-63-57-29-17-27-55(43-57)61(47-23-13-7-14-24-47)53-39-35-51(36-40-53)59(45-19-9-5-10-20-45)49-31-33-50(34-32-49)60(46-21-11-6-12-22-46)52-37-41-54(42-38-52)62(48-25-15-8-16-26-48)56-28-18-30-58(44-56)64-4-2;1-43-28-30-57(40-45(43)3)61(49-22-13-7-14-23-49)53-36-32-51(33-37-53)59(47-18-9-5-10-19-47)55-26-17-27-56(42-55)60(48-20-11-6-12-21-48)52-34-38-54(39-35-52)62(50-24-15-8-16-25-50)58-31-29-44(2)46(4)41-58;1-43-18-26-49(27-19-43)59(47-12-7-5-8-13-47)53-34-38-55(39-35-53)61(51-30-22-45(3)23-31-51)57-16-11-17-58(42-57)62(52-32-24-46(4)25-33-52)56-40-36-54(37-41-56)60(48-14-9-6-10-15-48)50-28-20-44(2)21-29-50;1-43-18-15-28-53(40-43)57(45-20-7-3-8-21-45)49-32-36-51(37-33-49)59(47-24-11-5-12-25-47)55-30-17-31-56(42-55)60(48-26-13-6-14-27-48)52-38-34-50(35-39-52)58(46-22-9-4-10-23-46)54-29-16-19-44(2)41-54;1-43-26-30-49(31-27-43)59(53-38-34-51(35-39-53)57(45-16-7-3-8-17-45)46-18-9-4-10-19-46)55-24-15-25-56(42-55)60(50-32-28-44(2)29-33-50)54-40-36-52(37-41-54)58(47-20-11-5-12-21-47)48-22-13-6-14-23-48;1-43-19-17-30-53(41-43)59(52-39-35-50(36-40-52)57(46-24-11-4-12-25-46)47-26-13-5-14-27-47)55-32-18-31-54(42-55)58(48-28-15-6-16-29-48)51-37-33-49(34-38-51)56(44-20-7-2-8-21-44)45-22-9-3-10-23-45/h5-44H,3-4H2,1-2H3;2*5-42H,1-4H3;2*3-42H,1-2H3;2-42H,1H3.

What are the key properties of 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine?

1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine has a molecular weight of 4752.20 g/mol, XLogP of 98.20, 76 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 1-N,3-N-bis[4-(N-(3,4-dimethylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,4-N-bis[4-(N-(3-ethoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,3-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-(4-methylphenyl)anilino)phenyl]benzene-1,3-diamine;1-N,3-N-bis(4-methylphenyl)-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine;3-N-(3-methylphenyl)-1-N-phenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine is sourced from PubChem (CID 159029293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).