1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

C232H195B4Br5IN9O8 — CID 158768472

About 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (PubChem CID 158768472) has the molecular formula C232H195B4Br5IN9O8 and a molecular weight of 3806.84 g/mol. Its IUPAC name is 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

Molecular Properties

• Compound Name: 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• PubChem CID: 158768472
• Molecular Formula: C232H195B4Br5IN9O8
• Molecular Weight: 3806.84 g/mol
• Exact Mass: 3800.05
• IUPAC Name: 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• SMILES: Brc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1.Brc1ccc(I)cc1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2)OC1(C)C.CC1(C)OB(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)OC1(C)C.c1ccc(N(c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7nc8ccccc8n7-c7ccccc7)cc6)cc5)cc4)cc3)cc2)c2cccc3ccccc23)cc1.c1ccc(Nc2cccc3ccccc23)cc1
• InChI: InChI=1S/C59H41N3.C34H32BNO2.C34H24BrN.C31H29BN2O2.C28H20BrN.C16H13N.C12H24B2O4.C12H8Br2.C6H4BrI/c1-3-14-52(15-4-1)61(57-21-11-13-50-12-7-8-18-55(50)57)54-40-38-49(39-41-54)47-32-30-45(31-33-47)43-24-22-42(23-25-43)44-26-28-46(29-27-44)48-34-36-51(37-35-48)59-60-56-19-9-10-20-58(56)62(59)53-16-5-2-6-17-53;1-33(2)34(3,4)38-35(37-33)28-21-17-25(18-22-28)26-19-23-30(24-20-26)36(29-13-6-5-7-14-29)32-16-10-12-27-11-8-9-15-31(27)32;35-30-21-17-27(18-22-30)25-13-15-26(16-14-25)28-19-23-32(24-20-28)36(31-9-2-1-3-10-31)34-12-6-8-29-7-4-5-11-33(29)34;1-30(2)31(3,4)36-32(35-30)25-20-18-23(19-21-25)22-14-16-24(17-15-22)29-33-27-12-8-9-13-28(27)34(29)26-10-6-5-7-11-26;29-24-17-13-21(14-18-24)22-15-19-26(20-16-22)30(25-9-2-1-3-10-25)28-12-6-8-23-7-4-5-11-27(23)28;1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10;7-5-1-3-6(8)4-2-5/h1-41H;5-24H,1-4H3;1-24H;5-21H,1-4H3;1-20H;1-12,17H;1-8H3;1-8H;1-4H
• InChIKey: IPOGZBLDFOAPQL-UHFFFAOYSA-N
• XLogP: 64.83
• TPSA: 134.47 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 17
• Rotatable Bonds: 31
• Heavy Atoms: 259
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3806.84
LogP ≤ 5	64.83
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The IUPAC name of 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (CID 158768472) is 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

What is the SMILES notation for 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The canonical SMILES for 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is Brc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1.Brc1ccc(-c2ccc(Br)cc2)cc1.Brc1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1.Brc1ccc(I)cc1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2)OC1(C)C.CC1(C)OB(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)OC1(C)C.c1ccc(N(c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7nc8ccccc8n7-c7ccccc7)cc6)cc5)cc4)cc3)cc2)c2cccc3ccccc23)cc1.c1ccc(Nc2cccc3ccccc23)cc1.

What is the InChIKey of 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The InChIKey is IPOGZBLDFOAPQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H41N3.C34H32BNO2.C34H24BrN.C31H29BN2O2.C28H20BrN.C16H13N.C12H24B2O4.C12H8Br2.C6H4BrI/c1-3-14-52(15-4-1)61(57-21-11-13-50-12-7-8-18-55(50)57)54-40-38-49(39-41-54)47-32-30-45(31-33-47)43-24-22-42(23-25-43)44-26-28-46(29-27-44)48-34-36-51(37-35-48)59-60-56-19-9-10-20-58(56)62(59)53-16-5-2-6-17-53;1-33(2)34(3,4)38-35(37-33)28-21-17-25(18-22-28)26-19-23-30(24-20-26)36(29-13-6-5-7-14-29)32-16-10-12-27-11-8-9-15-31(27)32;35-30-21-17-27(18-22-30)25-13-15-26(16-14-25)28-19-23-32(24-20-28)36(31-9-2-1-3-10-31)34-12-6-8-29-7-4-5-11-33(29)34;1-30(2)31(3,4)36-32(35-30)25-20-18-23(19-21-25)22-14-16-24(17-15-22)29-33-27-12-8-9-13-28(27)34(29)26-10-6-5-7-11-26;29-24-17-13-21(14-18-24)22-15-19-26(20-16-22)30(25-9-2-1-3-10-25)28-12-6-8-23-7-4-5-11-27(23)28;1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10;7-5-1-3-6(8)4-2-5/h1-41H;5-24H,1-4H3;1-24H;5-21H,1-4H3;1-20H;1-12,17H;1-8H3;1-8H;1-4H.

What are the key properties of 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane has a molecular weight of 3806.84 g/mol, XLogP of 64.83, 31 rotatable bonds, 1 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 1-bromo-4-(4-bromophenyl)benzene;1-bromo-4-iodobenzene;N-[4-(4-bromophenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;N-phenyl-N-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]naphthalen-1-amine;1-phenyl-2-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]benzimidazole;N-phenyl-N-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenyl]naphthalen-1-amine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is sourced from PubChem (CID 158768472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).