3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

C141H126B4Br2ClN9O8 — CID 158024458

About 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (PubChem CID 158024458) has the molecular formula C141H126B4Br2ClN9O8 and a molecular weight of 2313.12 g/mol. Its IUPAC name is 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;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: 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• PubChem CID: 158024458
• Molecular Formula: C141H126B4Br2ClN9O8
• Molecular Weight: 2313.12 g/mol
• Exact Mass: 2309.82
• IUPAC Name: 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• SMILES: Brc1cncc(Br)c1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2cncc(B3OC(C)(C)C(C)(C)O3)c2)OC1(C)C.Clc1cccc(-c2cc(-c3cccc(-c4cccnc4)c3)cc(-c3cccc(-c4cccnc4)c3)c2)c1.c1cncc(-c2cccc(-c3cc(-c4cccc(-c5cccnc5)c4)cc(-c4cccc(-c5cncc(-c6cccc(-c7cc(-c8cccc(-c9cccnc9)c8)cc(-c8cccc(-c9cccnc9)c8)c7)c6)c5)c4)c3)c2)c1
• InChI: InChI=1S/C73H49N5.C34H23ClN2.C17H27B2NO4.C12H24B2O4.C5H3Br2N/c1-11-50(62-23-7-27-74-44-62)31-54(15-1)66-37-67(55-16-2-12-51(32-55)63-24-8-28-75-45-63)40-70(39-66)58-19-5-21-60(35-58)72-43-73(49-78-48-72)61-22-6-20-59(36-61)71-41-68(56-17-3-13-52(33-56)64-25-9-29-76-46-64)38-69(42-71)57-18-4-14-53(34-57)65-26-10-30-77-47-65;35-34-13-3-10-28(21-34)33-19-31(26-8-1-6-24(16-26)29-11-4-14-36-22-29)18-32(20-33)27-9-2-7-25(17-27)30-12-5-15-37-23-30;1-14(2)15(3,4)22-18(21-14)12-9-13(11-20-10-12)19-23-16(5,6)17(7,8)24-19;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;6-4-1-5(7)3-8-2-4/h1-49H;1-23H;9-11H,1-8H3;1-8H3;1-3H
• InChIKey: FGLBQGGKJBASCQ-UHFFFAOYSA-N
• XLogP: 34.67
• TPSA: 189.85 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 20
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2313.12
LogP ≤ 5	34.67
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;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 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (CID 158024458) is 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;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 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;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 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is Brc1cncc(Br)c1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2cncc(B3OC(C)(C)C(C)(C)O3)c2)OC1(C)C.Clc1cccc(-c2cc(-c3cccc(-c4cccnc4)c3)cc(-c3cccc(-c4cccnc4)c3)c2)c1.c1cncc(-c2cccc(-c3cc(-c4cccc(-c5cccnc5)c4)cc(-c4cccc(-c5cncc(-c6cccc(-c7cc(-c8cccc(-c9cccnc9)c8)cc(-c8cccc(-c9cccnc9)c8)c7)c6)c5)c4)c3)c2)c1.

What is the InChIKey of 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The InChIKey is FGLBQGGKJBASCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H49N5.C34H23ClN2.C17H27B2NO4.C12H24B2O4.C5H3Br2N/c1-11-50(62-23-7-27-74-44-62)31-54(15-1)66-37-67(55-16-2-12-51(32-55)63-24-8-28-75-45-63)40-70(39-66)58-19-5-21-60(35-58)72-43-73(49-78-48-72)61-22-6-20-59(36-61)71-41-68(56-17-3-13-52(33-56)64-25-9-29-76-46-64)38-69(42-71)57-18-4-14-53(34-57)65-26-10-30-77-47-65;35-34-13-3-10-28(21-34)33-19-31(26-8-1-6-24(16-26)29-11-4-14-36-22-29)18-32(20-33)27-9-2-7-25(17-27)30-12-5-15-37-23-30;1-14(2)15(3,4)22-18(21-14)12-9-13(11-20-10-12)19-23-16(5,6)17(7,8)24-19;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;6-4-1-5(7)3-8-2-4/h1-49H;1-23H;9-11H,1-8H3;1-8H3;1-3H.

What are the key properties of 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;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 2313.12 g/mol, XLogP of 34.67, 20 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-bis[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;3-[3-[3-(3-chlorophenyl)-5-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;3,5-dibromopyridine;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 158024458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).