bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide

C225H183Ir8N18O3-9 — CID 159331384

About bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide

bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide (PubChem CID 159331384) has the molecular formula C225H183Ir8N18O3-9 and a molecular weight of 4724.80 g/mol. Its IUPAC name is bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide.

Molecular Properties

• Compound Name: bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide
• PubChem CID: 159331384
• Molecular Formula: C225H183Ir8N18O3-9
• Molecular Weight: 4724.80 g/mol
• Exact Mass: 4728.18
• IUPAC Name: bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide
• SMILES: Cc1cc(-c2ccccc2)cc(C)c1-c1cnc2c3[c-]cccc3c3ccccc3n12.Cc1cc(C)c(-c2cnc3c4[c-]cc(-c5c(C)cccc5C)cc4c4ccccc4n23)c(C)c1.Cc1cc(C)c(-c2cnc3c4[c-]cc(Cc5ccccc5)cc4c4ccc(C)cc4n23)c(C)c1.Cc1cc(C)c(-c2cnc3c4[c-]cccc4c4cc(C)ccc4n23)c(C)c1.Cc1cc(C)c(-c2cnc3c4[c-]cccc4c4ccccc4n23)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]c3ccoc3cc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]c3ccoc3cc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3occc3c2)c(C)c1.Cc1cccc(C)c1-c1cnc2c3[c-]cccc3c3ccccc3n12.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/2C32H27N2.C29H21N2.C25H21N2.C24H19N2.C23H17N2.3C20H17N2O.8Ir/c1-19-15-22(4)31(23(5)16-19)29-18-33-32-26-14-13-24(30-20(2)9-8-10-21(30)3)17-27(26)25-11-6-7-12-28(25)34(29)32;1-20-10-12-26-28-18-25(17-24-8-6-5-7-9-24)11-13-27(28)32-33-19-30(34(32)29(26)16-20)31-22(3)14-21(2)15-23(31)4;1-19-16-22(21-10-4-3-5-11-21)17-20(2)28(19)27-18-30-29-25-14-7-6-12-23(25)24-13-8-9-15-26(24)31(27)29;1-15-9-10-22-21(13-15)19-7-5-6-8-20(19)25-26-14-23(27(22)25)24-17(3)11-16(2)12-18(24)4;1-15-12-16(2)23(17(3)13-15)22-14-25-24-20-10-5-4-8-18(20)19-9-6-7-11-21(19)26(22)24;1-15-8-7-9-16(2)22(15)21-14-24-23-19-12-4-3-10-17(19)18-11-5-6-13-20(18)25(21)23;3*1-13-10-14(2)19(15(3)11-13)22-8-7-21-20(22)17-4-5-18-16(12-17)6-9-23-18;;;;;;;;/h6-13,15-18H,1-5H3;5-12,14-16,18-19H,17H2,1-4H3;3-13,15-18H,1-2H3;5-7,9-14H,1-4H3;4-9,11-14H,1-3H3;3-11,13-14H,1-2H3;5-12H,1-3H3;2*4-11H,1-3H3;;;;;;;;/q9*-1
• InChIKey: JGAGGYLYVJQITG-UHFFFAOYSA-N
• XLogP: 56.75
• TPSA: 196.68 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 16
• Heavy Atoms: 254
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4724.80
LogP ≤ 5	56.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide?

The IUPAC name of bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide (CID 159331384) is bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide.

What is the SMILES notation for bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide?

The canonical SMILES for bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide is Cc1cc(-c2ccccc2)cc(C)c1-c1cnc2c3[c-]cccc3c3ccccc3n12.Cc1cc(C)c(-c2cnc3c4[c-]cc(-c5c(C)cccc5C)cc4c4ccccc4n23)c(C)c1.Cc1cc(C)c(-c2cnc3c4[c-]cc(Cc5ccccc5)cc4c4ccc(C)cc4n23)c(C)c1.Cc1cc(C)c(-c2cnc3c4[c-]cccc4c4cc(C)ccc4n23)c(C)c1.Cc1cc(C)c(-c2cnc3c4[c-]cccc4c4ccccc4n23)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]c3ccoc3cc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]c3ccoc3cc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3occc3c2)c(C)c1.Cc1cccc(C)c1-c1cnc2c3[c-]cccc3c3ccccc3n12.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide?

The InChIKey is JGAGGYLYVJQITG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C32H27N2.C29H21N2.C25H21N2.C24H19N2.C23H17N2.3C20H17N2O.8Ir/c1-19-15-22(4)31(23(5)16-19)29-18-33-32-26-14-13-24(30-20(2)9-8-10-21(30)3)17-27(26)25-11-6-7-12-28(25)34(29)32;1-20-10-12-26-28-18-25(17-24-8-6-5-7-9-24)11-13-27(28)32-33-19-30(34(32)29(26)16-20)31-22(3)14-21(2)15-23(31)4;1-19-16-22(21-10-4-3-5-11-21)17-20(2)28(19)27-18-30-29-25-14-7-6-12-23(25)24-13-8-9-15-26(24)31(27)29;1-15-9-10-22-21(13-15)19-7-5-6-8-20(19)25-26-14-23(27(22)25)24-17(3)11-16(2)12-18(24)4;1-15-12-16(2)23(17(3)13-15)22-14-25-24-20-10-5-4-8-18(20)19-9-6-7-11-21(19)26(22)24;1-15-8-7-9-16(2)22(15)21-14-24-23-19-12-4-3-10-17(19)18-11-5-6-13-20(18)25(21)23;3*1-13-10-14(2)19(15(3)11-13)22-8-7-21-20(22)17-4-5-18-16(12-17)6-9-23-18;;;;;;;;/h6-13,15-18H,1-5H3;5-12,14-16,18-19H,17H2,1-4H3;3-13,15-18H,1-2H3;5-7,9-14H,1-4H3;4-9,11-14H,1-3H3;3-11,13-14H,1-2H3;5-12H,1-3H3;2*4-11H,1-3H3;;;;;;;;/q9*-1;;;;;;;;.

What are the key properties of bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide?

bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide has a molecular weight of 4724.80 g/mol, XLogP of 56.75, 16 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-(4H-1-benzofuran-4-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole);2-(6H-1-benzofuran-6-id-5-yl)-1-(2,4,6-trimethylphenyl)imidazole;10-benzyl-6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,6-dimethyl-4-phenylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;10-(2,6-dimethylphenyl)-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;octakis(iridium);7-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide is sourced from PubChem (CID 159331384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).