N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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

C143H134B4Br4N6O8 — CID 158176584

About N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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

N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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 158176584) has the molecular formula C143H134B4Br4N6O8 and a molecular weight of 2427.54 g/mol. Its IUPAC name is N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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: N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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: 158176584
• Molecular Formula: C143H134B4Br4N6O8
• Molecular Weight: 2427.54 g/mol
• Exact Mass: 2422.74
• IUPAC Name: N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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(Br)cc1.Brc1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1.Brc1ccccc1-c1ccccc1-c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)OC1(C)C.CC1(C)OB(c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)OC1(C)C.c1ccc(Nc2cccc3ccccc23)cc1
• InChI: InChI=1S/C31H21BrN2.2C28H28BNO2.C22H16BrN.C16H13N.C12H24B2O4.C6H4Br2/c32-28-15-7-6-14-27(28)26-13-5-4-12-25(26)22-18-20-23(21-19-22)31-33-29-16-8-9-17-30(29)34(31)24-10-2-1-3-11-24;2*1-27(2)28(3,4)32-29(31-27)22-17-19-24(20-18-22)30(23-13-6-5-7-14-23)26-16-10-12-21-11-8-9-15-25(21)26;23-18-13-15-20(16-14-18)24(19-9-2-1-3-10-19)22-12-6-8-17-7-4-5-11-21(17)22;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;7-5-1-2-6(8)4-3-5/h1-21H;2*5-20H,1-4H3;1-16H;1-12,17H;1-8H3;1-4H
• InChIKey: FYBNWZHESNPCNC-UHFFFAOYSA-N
• XLogP: 39.12
• TPSA: 113.41 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 18
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2427.54
LogP ≤ 5	39.12
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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 N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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 158176584) is N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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 N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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 N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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(Br)cc1.Brc1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1.Brc1ccccc1-c1ccccc1-c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)OC1(C)C.CC1(C)OB(c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)OC1(C)C.c1ccc(Nc2cccc3ccccc23)cc1.

What is the InChIKey of N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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 FYBNWZHESNPCNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21BrN2.2C28H28BNO2.C22H16BrN.C16H13N.C12H24B2O4.C6H4Br2/c32-28-15-7-6-14-27(28)26-13-5-4-12-25(26)22-18-20-23(21-19-22)31-33-29-16-8-9-17-30(29)34(31)24-10-2-1-3-11-24;2*1-27(2)28(3,4)32-29(31-27)22-17-19-24(20-18-22)30(23-13-6-5-7-14-23)26-16-10-12-21-11-8-9-15-25(21)26;23-18-13-15-20(16-14-18)24(19-9-2-1-3-10-19)22-12-6-8-17-7-4-5-11-21(17)22;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;7-5-1-2-6(8)4-3-5/h1-21H;2*5-20H,1-4H3;1-16H;1-12,17H;1-8H3;1-4H.

What are the key properties of N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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?

N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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 2427.54 g/mol, XLogP of 39.12, 18 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-bromophenyl)-N-phenylnaphthalen-1-amine;2-[4-[2-(2-bromophenyl)phenyl]phenyl]-1-phenylbenzimidazole;1,4-dibromobenzene;N-phenylnaphthalen-1-amine;bis(N-phenyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)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 158176584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).