2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine

C246H176F3N39 — CID 158818180

About 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine

2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine (PubChem CID 158818180) has the molecular formula C246H176F3N39 and a molecular weight of 3735.38 g/mol. Its IUPAC name is 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine.

Molecular Properties

• Compound Name: 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine
• PubChem CID: 158818180
• Molecular Formula: C246H176F3N39
• Molecular Weight: 3735.38 g/mol
• Exact Mass: 3732.49
• IUPAC Name: 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine
• SMILES: CC(C)(C)c1ccc(-n2c(-c3cc(-c4nc5ccccc5n4-c4ccc(C(C)(C)C)cc4)cc(-c4nc5ccccc5n4-c4ccc(C(C)(C)C)cc4)c3)nc3ccccc32)cc1.Cc1cccc(-n2c(-c3cc(-c4nc5ccccc5n4-c4cccc(C)c4)cc(-c4nc5ccccc5n4-c4cccc(C(F)(F)F)c4)c3)nc3ccccc32)c1.c1ccc(-c2cccc(-n3c(-c4cc(-c5nc6cccnc6n5-c5cccc(-c6ccccc6)c5)cc(-c5nc6cccnc6n5-c5cccc(-c6ccccc6)c5)c4)nc4cccnc43)c2)cc1.c1ccc(-n2c(-c3ccc(-c4nc5ncccc5n4-c4ccccc4)cc3)nc3ncccc32)cc1.c1cnc2c(-n3c(-c4cc(-c5nc6cccnc6n5-c5cccc6cccnc56)cc(-c5nc6cccnc6n5-c5cccc6cccnc56)c4)nc4cccnc43)cccc2c1
• InChI: InChI=1S/C60H39N9.C57H54N6.C51H30N12.C48H33F3N6.C30H20N6/c1-4-16-40(17-5-1)43-22-10-25-49(37-43)67-55(64-52-28-13-31-61-58(52)67)46-34-47(56-65-53-29-14-32-62-59(53)68(56)50-26-11-23-44(38-50)41-18-6-2-7-19-41)36-48(35-46)57-66-54-30-15-33-63-60(54)69(57)51-27-12-24-45(39-51)42-20-8-3-9-21-42;1-55(2,3)40-22-28-43(29-23-40)61-49-19-13-10-16-46(49)58-52(61)37-34-38(53-59-47-17-11-14-20-50(47)62(53)44-30-24-41(25-31-44)56(4,5)6)36-39(35-37)54-60-48-18-12-15-21-51(48)63(54)45-32-26-42(27-33-45)57(7,8)9;1-10-31-13-4-22-52-43(31)40(19-1)61-46(58-37-16-7-25-55-49(37)61)34-28-35(47-59-38-17-8-26-56-50(38)62(47)41-20-2-11-32-14-5-23-53-44(32)41)30-36(29-34)48-60-39-18-9-27-57-51(39)63(48)42-21-3-12-33-15-6-24-54-45(33)42;1-30-12-9-15-36(24-30)55-42-21-6-3-18-39(42)52-45(55)32-26-33(46-53-40-19-4-7-22-43(40)56(46)37-16-10-13-31(2)25-37)28-34(27-32)47-54-41-20-5-8-23-44(41)57(47)38-17-11-14-35(29-38)48(49,50)51;1-3-9-23(10-4-1)35-25-13-7-19-31-27(25)33-29(35)21-15-17-22(18-16-21)30-34-28-26(14-8-20-32-28)36(30)24-11-5-2-6-12-24/h1-39H;10-36H,1-9H3;1-30H;3-29H,1-2H3;1-20H
• InChIKey: IVNOOBXGBNJJLM-UHFFFAOYSA-N
• XLogP: 57.85
• TPSA: 391.27 Ų
• H-Bond Acceptors: 39
• Rotatable Bonds: 31
• Heavy Atoms: 288
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3735.38
LogP ≤ 5	57.85
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	39

Frequently Asked Questions

What is the IUPAC name of 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine?

The IUPAC name of 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine (CID 158818180) is 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine.

What is the SMILES notation for 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine?

The canonical SMILES for 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine is CC(C)(C)c1ccc(-n2c(-c3cc(-c4nc5ccccc5n4-c4ccc(C(C)(C)C)cc4)cc(-c4nc5ccccc5n4-c4ccc(C(C)(C)C)cc4)c3)nc3ccccc32)cc1.Cc1cccc(-n2c(-c3cc(-c4nc5ccccc5n4-c4cccc(C)c4)cc(-c4nc5ccccc5n4-c4cccc(C(F)(F)F)c4)c3)nc3ccccc32)c1.c1ccc(-c2cccc(-n3c(-c4cc(-c5nc6cccnc6n5-c5cccc(-c6ccccc6)c5)cc(-c5nc6cccnc6n5-c5cccc(-c6ccccc6)c5)c4)nc4cccnc43)c2)cc1.c1ccc(-n2c(-c3ccc(-c4nc5ncccc5n4-c4ccccc4)cc3)nc3ncccc32)cc1.c1cnc2c(-n3c(-c4cc(-c5nc6cccnc6n5-c5cccc6cccnc56)cc(-c5nc6cccnc6n5-c5cccc6cccnc56)c4)nc4cccnc43)cccc2c1.

What is the InChIKey of 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine?

The InChIKey is IVNOOBXGBNJJLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H39N9.C57H54N6.C51H30N12.C48H33F3N6.C30H20N6/c1-4-16-40(17-5-1)43-22-10-25-49(37-43)67-55(64-52-28-13-31-61-58(52)67)46-34-47(56-65-53-29-14-32-62-59(53)68(56)50-26-11-23-44(38-50)41-18-6-2-7-19-41)36-48(35-46)57-66-54-30-15-33-63-60(54)69(57)51-27-12-24-45(39-51)42-20-8-3-9-21-42;1-55(2,3)40-22-28-43(29-23-40)61-49-19-13-10-16-46(49)58-52(61)37-34-38(53-59-47-17-11-14-20-50(47)62(53)44-30-24-41(25-31-44)56(4,5)6)36-39(35-37)54-60-48-18-12-15-21-51(48)63(54)45-32-26-42(27-33-45)57(7,8)9;1-10-31-13-4-22-52-43(31)40(19-1)61-46(58-37-16-7-25-55-49(37)61)34-28-35(47-59-38-17-8-26-56-50(38)62(47)41-20-2-11-32-14-5-23-53-44(32)41)30-36(29-34)48-60-39-18-9-27-57-51(39)63(48)42-21-3-12-33-15-6-24-54-45(33)42;1-30-12-9-15-36(24-30)55-42-21-6-3-18-39(42)52-45(55)32-26-33(46-53-40-19-4-7-22-43(40)56(46)37-16-10-13-31(2)25-37)28-34(27-32)47-54-41-20-5-8-23-44(41)57(47)38-17-11-14-35(29-38)48(49,50)51;1-3-9-23(10-4-1)35-25-13-7-19-31-27(25)33-29(35)21-15-17-22(18-16-21)30-34-28-26(14-8-20-32-28)36(30)24-11-5-2-6-12-24/h1-39H;10-36H,1-9H3;1-30H;3-29H,1-2H3;1-20H.

What are the key properties of 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine?

2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine has a molecular weight of 3735.38 g/mol, XLogP of 57.85, 31 rotatable bonds, 0 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3,5-bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine is sourced from PubChem (CID 158818180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).