3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine

C333H224F3N57 — CID 158550721

IUPAC3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine
SMILESCc1cccc(-n2c(-c3cc(-c4nc5ccccc5n4-c4cccc(C)c4)cc(-c4nc5ccccc5n4-c4cccc(C(F)(F)F)c4)c3)nc3ccccc32)c1.Cc1cccc(C)c1-n1c(-c2ccc(-c3ccc(-c4nc5cccnc5n4-c4c(C)cccc4C)cc3)cc2)nc2cccnc21.Cc1ccccc1-n1c(-c2ccc(-c3ccc(-c4nc5cccnc5n4-c4ccccc4C)cc3)cc2)nc2cccnc21.[C-]#[N+]c1cccc(-n2c(-c3cc(-c4nc5cccnc5n4-c4cccc(C#N)c4)cc(-c4nc5cccnc5n4-c4cccc([N+]#[C-])c4)c3)nc3cccnc32)c1.c1ccc(-c2ccccc2-n2c(-c3ccc(-c4ccc(-c5nc6cccnc6n5-c5ccccc5-c5ccccc5)cc4)cc3)nc3cccnc32)cc1.c1ccc(-n2c(-c3cc(-c4nc5cccnc5n4-c4ccccc4)cc(-c4nc5cccnc5n4-c4ccccc4)c3)nc3cccnc32)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5nc6cccnc6n5-c5ccccc5)cc4)cc3)nc3cccnc32)cc1.c1ccc(-n2c(-c3cccc(-c4cccc(-c5nc6ncccc6n5-c5ccccc5)c4)c3)nc3ncccc32)cc1
InChIInChI=1S/C48H33F3N6.C48H32N6.C45H24N12.C42H27N9.C40H32N6.C38H28N6.2C36H24N6/c1-30-12-9-15-36(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;1-3-13-35(14-4-1)39-17-7-9-21-43(39)53-45(51-41-19-11-31-49-47(41)53)37-27-23-33(24-28-37)34-25-29-38(30-26-34)46-52-42-20-12-32-50-48(42)54(46)44-22-10-8-18-40(44)36-15-5-2-6-16-36;1-47-32-10-4-13-35(25-32)56-41(53-38-16-7-19-50-44(38)56)30-22-29(40-52-37-15-6-18-49-43(37)55(40)34-12-3-9-28(21-34)27-46)23-31(24-30)42-54-39-17-8-20-51-45(39)57(42)36-14-5-11-33(26-36)48-2;1-4-13-31(14-5-1)49-37(46-34-19-10-22-43-40(34)49)28-25-29(38-47-35-20-11-23-44-41(35)50(38)32-15-6-2-7-16-32)27-30(26-28)39-48-36-21-12-24-45-42(36)51(39)33-17-8-3-9-18-33;1-25-9-5-10-26(2)35(25)45-37(43-33-13-7-23-41-39(33)45)31-19-15-29(16-20-31)30-17-21-32(22-18-30)38-44-34-14-8-24-42-40(34)46(38)36-27(3)11-6-12-28(36)4;1-25-9-3-5-13-33(25)43-35(41-31-11-7-23-39-37(31)43)29-19-15-27(16-20-29)28-17-21-30(22-18-28)36-42-32-12-8-24-40-38(32)44(36)34-14-6-4-10-26(34)2;1-3-15-29(16-4-1)41-31-19-9-21-37-33(31)39-35(41)27-13-7-11-25(23-27)26-12-8-14-28(24-26)36-40-34-32(20-10-22-38-34)42(36)30-17-5-2-6-18-30;1-3-9-29(10-4-1)41-33(39-31-13-7-23-37-35(31)41)27-19-15-25(16-20-27)26-17-21-28(22-18-26)34-40-32-14-8-24-38-36(32)42(34)30-11-5-2-6-12-30/h3-29H,1-2H3;1-32H;3-26H;1-27H;5-24H,1-4H3;3-24H,1-2H3;2*1-24H
InChIKeyHPRLBJZCQIZCCJ-UHFFFAOYSA-N
MW5080.85 g/mol
LogP77.05
Rot. Bonds45

About 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine

3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine (PubChem CID 158550721) has the molecular formula C333H224F3N57 and a molecular weight of 5080.85 g/mol. Its IUPAC name is 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine
PubChem CID158550721
Molecular FormulaC333H224F3N57
Molecular Weight5080.85 g/mol
Exact Mass5076.92
IUPAC Name3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine
SMILESCc1cccc(-n2c(-c3cc(-c4nc5ccccc5n4-c4cccc(C)c4)cc(-c4nc5ccccc5n4-c4cccc(C(F)(F)F)c4)c3)nc3ccccc32)c1.Cc1cccc(C)c1-n1c(-c2ccc(-c3ccc(-c4nc5cccnc5n4-c4c(C)cccc4C)cc3)cc2)nc2cccnc21.Cc1ccccc1-n1c(-c2ccc(-c3ccc(-c4nc5cccnc5n4-c4ccccc4C)cc3)cc2)nc2cccnc21.[C-]#[N+]c1cccc(-n2c(-c3cc(-c4nc5cccnc5n4-c4cccc(C#N)c4)cc(-c4nc5cccnc5n4-c4cccc([N+]#[C-])c4)c3)nc3cccnc32)c1.c1ccc(-c2ccccc2-n2c(-c3ccc(-c4ccc(-c5nc6cccnc6n5-c5ccccc5-c5ccccc5)cc4)cc3)nc3cccnc32)cc1.c1ccc(-n2c(-c3cc(-c4nc5cccnc5n4-c4ccccc4)cc(-c4nc5cccnc5n4-c4ccccc4)c3)nc3cccnc32)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5nc6cccnc6n5-c5ccccc5)cc4)cc3)nc3cccnc32)cc1.c1ccc(-n2c(-c3cccc(-c4cccc(-c5nc6ncccc6n5-c5ccccc5)c4)c3)nc3ncccc32)cc1
InChIInChI=1S/C48H33F3N6.C48H32N6.C45H24N12.C42H27N9.C40H32N6.C38H28N6.2C36H24N6/c1-30-12-9-15-36(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;1-3-13-35(14-4-1)39-17-7-9-21-43(39)53-45(51-41-19-11-31-49-47(41)53)37-27-23-33(24-28-37)34-25-29-38(30-26-34)46-52-42-20-12-32-50-48(42)54(46)44-22-10-8-18-40(44)36-15-5-2-6-16-36;1-47-32-10-4-13-35(25-32)56-41(53-38-16-7-19-50-44(38)56)30-22-29(40-52-37-15-6-18-49-43(37)55(40)34-12-3-9-28(21-34)27-46)23-31(24-30)42-54-39-17-8-20-51-45(39)57(42)36-14-5-11-33(26-36)48-2;1-4-13-31(14-5-1)49-37(46-34-19-10-22-43-40(34)49)28-25-29(38-47-35-20-11-23-44-41(35)50(38)32-15-6-2-7-16-32)27-30(26-28)39-48-36-21-12-24-45-42(36)51(39)33-17-8-3-9-18-33;1-25-9-5-10-26(2)35(25)45-37(43-33-13-7-23-41-39(33)45)31-19-15-29(16-20-31)30-17-21-32(22-18-30)38-44-34-14-8-24-42-40(34)46(38)36-27(3)11-6-12-28(36)4;1-25-9-3-5-13-33(25)43-35(41-31-11-7-23-39-37(31)43)29-19-15-27(16-20-29)28-17-21-30(22-18-28)36-42-32-12-8-24-40-38(32)44(36)34-14-6-4-10-26(34)2;1-3-15-29(16-4-1)41-31-19-9-21-37-33(31)39-35(41)27-13-7-11-25(23-27)26-12-8-14-28(24-26)36-40-34-32(20-10-22-38-34)42(36)30-17-5-2-6-18-30;1-3-9-29(10-4-1)41-33(39-31-13-7-23-37-35(31)41)27-19-15-25(16-20-27)26-17-21-28(22-18-26)34-40-32-14-8-24-38-36(32)42(34)30-11-5-2-6-12-30/h3-29H,1-2H3;1-32H;3-26H;1-27H;5-24H,1-4H3;3-24H,1-2H3;2*1-24H
InChIKeyHPRLBJZCQIZCCJ-UHFFFAOYSA-N
XLogP77.05
TPSA577.33 Ų
H-Bond Donors
H-Bond Acceptors55
Rotatable Bonds45
Heavy Atoms393
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005080.85
LogP ≤ 577.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1055

Analyze 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine with MolForge

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Related Compounds

US9944647, Example 52
CID 122584004
1-[3-(Diethylamino)propylamino]-3-[3-(trifluoromethyl)phenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile; 3-[3-(trifluoromethyl)phenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
CID 71591157
1-[3-(Diethylamino)propylamino]-3-[4-(trifluoromethyl)phenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile; 3-[4-(trifluoromethyl)phenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
CID 71591292
1-[3-(Dimethylamino)propylamino]-3-[4-(trifluoromethyl)phenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile; 3-[4-(trifluoromethyl)phenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
CID 71591394
1-[3-(Dimethylamino)propylamino]-3-[3-(trifluoromethyl)phenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile; 3-[3-(trifluoromethyl)phenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
CID 71591395
2-[3,5-Bis[3-[2-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenyl]-3-[2-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridine
CID 20606860
3-(4-Fluorophenyl)-2-[3-[3-(4-fluorophenyl)imidazo[4,5-f][1,10]phenanthrolin-2-yl]phenyl]imidazo[4,5-f][1,10]phenanthroline
CID 74538788
1-(3-Methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]imidazo[4,5-b]pyridine
CID 89758127
7-(1,10-Diphenylpyrrolo[2,3-a]carbazol-7-yl)-10-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-(trifluoromethyl)phenyl]-3-phenylpyrrolo[3,2-a]carbazole
CID 90183220
2-[2,7-Bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-[2,4-bis(trifluoromethyl)phenyl]-6-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-(4-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile
CID 134473600
3-[2-[3-[3-(3-Cyanophenyl)imidazo[4,5-b]pyridin-2-yl]-5-[3-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile
CID 134534673
8-[4-[4,6-Bis(2,3,4,5,6-pentafluorophenyl)-1,3,5-triazin-2-yl]-2,6-di(carbazol-9-yl)phenyl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 135131058

Frequently Asked Questions

What is the IUPAC name of 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine?
The IUPAC name of 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine (CID 158550721) is 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine?
The canonical SMILES for 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine is Cc1cccc(-n2c(-c3cc(-c4nc5ccccc5n4-c4cccc(C)c4)cc(-c4nc5ccccc5n4-c4cccc(C(F)(F)F)c4)c3)nc3ccccc32)c1.Cc1cccc(C)c1-n1c(-c2ccc(-c3ccc(-c4nc5cccnc5n4-c4c(C)cccc4C)cc3)cc2)nc2cccnc21.Cc1ccccc1-n1c(-c2ccc(-c3ccc(-c4nc5cccnc5n4-c4ccccc4C)cc3)cc2)nc2cccnc21.[C-]#[N+]c1cccc(-n2c(-c3cc(-c4nc5cccnc5n4-c4cccc(C#N)c4)cc(-c4nc5cccnc5n4-c4cccc([N+]#[C-])c4)c3)nc3cccnc32)c1.c1ccc(-c2ccccc2-n2c(-c3ccc(-c4ccc(-c5nc6cccnc6n5-c5ccccc5-c5ccccc5)cc4)cc3)nc3cccnc32)cc1.c1ccc(-n2c(-c3cc(-c4nc5cccnc5n4-c4ccccc4)cc(-c4nc5cccnc5n4-c4ccccc4)c3)nc3cccnc32)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5nc6cccnc6n5-c5ccccc5)cc4)cc3)nc3cccnc32)cc1.c1ccc(-n2c(-c3cccc(-c4cccc(-c5nc6ncccc6n5-c5ccccc5)c4)c3)nc3ncccc32)cc1.
What is the InChIKey of 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine?
The InChIKey is HPRLBJZCQIZCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H33F3N6.C48H32N6.C45H24N12.C42H27N9.C40H32N6.C38H28N6.2C36H24N6/c1-30-12-9-15-36(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;1-3-13-35(14-4-1)39-17-7-9-21-43(39)53-45(51-41-19-11-31-49-47(41)53)37-27-23-33(24-28-37)34-25-29-38(30-26-34)46-52-42-20-12-32-50-48(42)54(46)44-22-10-8-18-40(44)36-15-5-2-6-16-36;1-47-32-10-4-13-35(25-32)56-41(53-38-16-7-19-50-44(38)56)30-22-29(40-52-37-15-6-18-49-43(37)55(40)34-12-3-9-28(21-34)27-46)23-31(24-30)42-54-39-17-8-20-51-45(39)57(42)36-14-5-11-33(26-36)48-2;1-4-13-31(14-5-1)49-37(46-34-19-10-22-43-40(34)49)28-25-29(38-47-35-20-11-23-44-41(35)50(38)32-15-6-2-7-16-32)27-30(26-28)39-48-36-21-12-24-45-42(36)51(39)33-17-8-3-9-18-33;1-25-9-5-10-26(2)35(25)45-37(43-33-13-7-23-41-39(33)45)31-19-15-29(16-20-31)30-17-21-32(22-18-30)38-44-34-14-8-24-42-40(34)46(38)36-27(3)11-6-12-28(36)4;1-25-9-3-5-13-33(25)43-35(41-31-11-7-23-39-37(31)43)29-19-15-27(16-20-29)28-17-21-30(22-18-28)36-42-32-12-8-24-40-38(32)44(36)34-14-6-4-10-26(34)2;1-3-15-29(16-4-1)41-31-19-9-21-37-33(31)39-35(41)27-13-7-11-25(23-27)26-12-8-14-28(24-26)36-40-34-32(20-10-22-38-34)42(36)30-17-5-2-6-18-30;1-3-9-29(10-4-1)41-33(39-31-13-7-23-37-35(31)41)27-19-15-25(16-20-27)26-17-21-28(22-18-26)34-40-32-14-8-24-38-36(32)42(34)30-11-5-2-6-12-30/h3-29H,1-2H3;1-32H;3-26H;1-27H;5-24H,1-4H3;3-24H,1-2H3;2*1-24H.
What are the key properties of 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine?
3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine has a molecular weight of 5080.85 g/mol, XLogP of 77.05, 45 rotatable bonds, 0 hydrogen bond donors, and 55 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[3,5-bis[3-(3-isocyanophenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridin-3-yl]benzonitrile;2-[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]-3-phenylimidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[4-[4-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;3-(2-methylphenyl)-2-[4-[4-[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine;1-phenyl-2-[3-[3-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-phenyl-2-[4-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]imidazo[4,5-b]pyridine;3-(2-phenylphenyl)-2-[4-[4-[3-(2-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]phenyl]imidazo[4,5-b]pyridine is sourced from PubChem (CID 158550721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).