1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine

C388H252N12O4S6 — CID 159307043

About 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine

1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine (PubChem CID 159307043) has the molecular formula C388H252N12O4S6 and a molecular weight of 5338.77 g/mol. Its IUPAC name is 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine.

Molecular Properties

• Compound Name: 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine
• PubChem CID: 159307043
• Molecular Formula: C388H252N12O4S6
• Molecular Weight: 5338.77 g/mol
• Exact Mass: 5333.82
• IUPAC Name: 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine
• SMILES: c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3cccc4ccccc34)c3cc(N(c4ccc5c(c4)oc4ccccc45)c4cccc5ccccc45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)sc3ccccc34)c3cccc4ccccc34)c3cc(N(c4ccc5c(c4)sc4ccccc45)c4cccc5ccccc45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4c3oc3ccccc34)c3cc(N(c4ccc5ccccc5c4)c4cccc5c4oc4ccccc45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4c3sc3ccccc34)c3cc(N(c4ccc5ccccc5c4)c4cccc5c4sc4ccccc45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4sc5ccccc5c34)c3cc(N(c4cccc5ccccc45)c4cccc5sc6ccccc6c45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccccc2N(c2ccccc2)c2cc(-c3ccccc3)c3c(-c4ccccc4)ccc(N(c4ccccc4)c4ccccc4-c4ccccc4)c3c2)cc1
• InChI: InChI=1S/2C66H42N2O2.3C66H42N2S2.C58H42N2/c1-3-17-45(18-4-1)52-37-38-61(68(60-30-16-24-44-22-8-10-26-51(44)60)48-34-36-56-54-28-12-14-32-63(54)70-65(56)42-48)58-40-49(39-57(66(52)58)46-19-5-2-6-20-46)67(59-29-15-23-43-21-7-9-25-50(43)59)47-33-35-55-53-27-11-13-31-62(53)69-64(55)41-47;1-3-19-45(20-4-1)51-38-39-59(68(58-31-15-25-44-23-9-10-26-50(44)58)61-33-17-30-55-53-28-12-14-35-63(53)70-66(55)61)57-42-49(41-56(64(51)57)46-21-5-2-6-22-46)67(48-37-36-43-18-7-8-24-47(43)40-48)60-32-16-29-54-52-27-11-13-34-62(52)69-65(54)60;1-3-19-45(20-4-1)50-39-40-57(68(56-32-16-26-44-24-8-10-28-49(44)56)59-34-18-38-63-66(59)52-30-12-14-36-61(52)70-63)54-42-47(41-53(64(50)54)46-21-5-2-6-22-46)67(55-31-15-25-43-23-7-9-27-48(43)55)58-33-17-37-62-65(58)51-29-11-13-35-60(51)69-62;1-3-17-45(18-4-1)52-37-38-61(68(60-30-16-24-44-22-8-10-26-51(44)60)48-34-36-56-54-28-12-14-32-63(54)70-65(56)42-48)58-40-49(39-57(66(52)58)46-19-5-2-6-20-46)67(59-29-15-23-43-21-7-9-25-50(43)59)47-33-35-55-53-27-11-13-31-62(53)69-64(55)41-47;1-3-19-45(20-4-1)51-38-39-59(68(58-31-15-25-44-23-9-10-26-50(44)58)61-33-17-30-55-53-28-12-14-35-63(53)70-66(55)61)57-42-49(41-56(64(51)57)46-21-5-2-6-22-46)67(48-37-36-43-18-7-8-24-47(43)40-48)60-32-16-29-54-52-27-11-13-34-62(52)69-65(54)60;1-7-23-43(24-8-1)50-35-19-21-37-55(50)59(47-31-15-5-16-32-47)49-41-53(46-29-13-4-14-30-46)58-52(45-27-11-3-12-28-45)39-40-57(54(58)42-49)60(48-33-17-6-18-34-48)56-38-22-20-36-51(56)44-25-9-2-10-26-44/h5*1-42H;1-42H
• InChIKey: LCAWURKMPUZQCR-UHFFFAOYSA-N
• XLogP: 115.35
• TPSA: 91.44 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 50
• Heavy Atoms: 410
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5338.77
LogP ≤ 5	115.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine?

The IUPAC name of 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine (CID 159307043) is 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine.

What is the SMILES notation for 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine?

The canonical SMILES for 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine is c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3cccc4ccccc34)c3cc(N(c4ccc5c(c4)oc4ccccc45)c4cccc5ccccc45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)sc3ccccc34)c3cccc4ccccc34)c3cc(N(c4ccc5c(c4)sc4ccccc45)c4cccc5ccccc45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4c3oc3ccccc34)c3cc(N(c4ccc5ccccc5c4)c4cccc5c4oc4ccccc45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4c3sc3ccccc34)c3cc(N(c4ccc5ccccc5c4)c4cccc5c4sc4ccccc45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccc(N(c3cccc4ccccc34)c3cccc4sc5ccccc5c34)c3cc(N(c4cccc5ccccc45)c4cccc5sc6ccccc6c45)cc(-c4ccccc4)c23)cc1.c1ccc(-c2ccccc2N(c2ccccc2)c2cc(-c3ccccc3)c3c(-c4ccccc4)ccc(N(c4ccccc4)c4ccccc4-c4ccccc4)c3c2)cc1.

What is the InChIKey of 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine?

The InChIKey is LCAWURKMPUZQCR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C66H42N2O2.3C66H42N2S2.C58H42N2/c1-3-17-45(18-4-1)52-37-38-61(68(60-30-16-24-44-22-8-10-26-51(44)60)48-34-36-56-54-28-12-14-32-63(54)70-65(56)42-48)58-40-49(39-57(66(52)58)46-19-5-2-6-20-46)67(59-29-15-23-43-21-7-9-25-50(43)59)47-33-35-55-53-27-11-13-31-62(53)69-64(55)41-47;1-3-19-45(20-4-1)51-38-39-59(68(58-31-15-25-44-23-9-10-26-50(44)58)61-33-17-30-55-53-28-12-14-35-63(53)70-66(55)61)57-42-49(41-56(64(51)57)46-21-5-2-6-22-46)67(48-37-36-43-18-7-8-24-47(43)40-48)60-32-16-29-54-52-27-11-13-34-62(52)69-65(54)60;1-3-19-45(20-4-1)50-39-40-57(68(56-32-16-26-44-24-8-10-28-49(44)56)59-34-18-38-63-66(59)52-30-12-14-36-61(52)70-63)54-42-47(41-53(64(50)54)46-21-5-2-6-22-46)67(55-31-15-25-43-23-7-9-27-48(43)55)58-33-17-37-62-65(58)51-29-11-13-35-60(51)69-62;1-3-17-45(18-4-1)52-37-38-61(68(60-30-16-24-44-22-8-10-26-51(44)60)48-34-36-56-54-28-12-14-32-63(54)70-65(56)42-48)58-40-49(39-57(66(52)58)46-19-5-2-6-20-46)67(59-29-15-23-43-21-7-9-25-50(43)59)47-33-35-55-53-27-11-13-31-62(53)69-64(55)41-47;1-3-19-45(20-4-1)51-38-39-59(68(58-31-15-25-44-23-9-10-26-50(44)58)61-33-17-30-55-53-28-12-14-35-63(53)70-66(55)61)57-42-49(41-56(64(51)57)46-21-5-2-6-22-46)67(48-37-36-43-18-7-8-24-47(43)40-48)60-32-16-29-54-52-27-11-13-34-62(52)69-65(54)60;1-7-23-43(24-8-1)50-35-19-21-37-55(50)59(47-31-15-5-16-32-47)49-41-53(46-29-13-4-14-30-46)58-52(45-27-11-3-12-28-45)39-40-57(54(58)42-49)60(48-33-17-6-18-34-48)56-38-22-20-36-51(56)44-25-9-2-10-26-44/h5*1-42H;1-42H.

What are the key properties of 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine?

1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine has a molecular weight of 5338.77 g/mol, XLogP of 115.35, 50 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 1-N,7-N-di(dibenzofuran-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzofuran-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-1-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-3-yl)-1-N,7-N-dinaphthalen-1-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N-di(dibenzothiophen-4-yl)-1-N-naphthalen-1-yl-7-N-naphthalen-2-yl-4,5-diphenylnaphthalene-1,7-diamine;1-N,7-N,4,5-tetraphenyl-1-N,7-N-bis(2-phenylphenyl)naphthalene-1,7-diamine is sourced from PubChem (CID 159307043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).