2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole

C189H158F2Ir6N14O9-6 — CID 157060877

About 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole

2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole (PubChem CID 157060877) has the molecular formula C189H158F2Ir6N14O9-6 and a molecular weight of 3960.73 g/mol. Its IUPAC name is 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole.

Molecular Properties

• Compound Name: 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole
• PubChem CID: 157060877
• Molecular Formula: C189H158F2Ir6N14O9-6
• Molecular Weight: 3960.73 g/mol
• Exact Mass: 3963.01
• IUPAC Name: 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole
• SMILES: COC(=O)C(C)(C)CC(C)(CCC(C)C#N)C(=O)OCCOc1cc(C)c(-n2ccnc2-c2[c-]cc(OC)cc2)c(C)c1.COc1c[c-]c(-c2nccn2-c2c(C)cccc2-c2ccccc2)cc1.Cc1cc(-c2ccccc2)c(-n2cc(-c3c(C)cccc3C)nc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(-c2ccccc2)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)CCCO3)c(C)c1.Cc1cccc(-c2ccccc2)c1-n1ccnc1-c1[c-]cc2oc3ccccc3c2c1.Fc1c[c-]c(-c2nccn2-c2c(-c3cccc4ccccc34)cccc2-c2cccc3ccccc23)c(F)c1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/C48H36N3.C35H21F2N2.C34H42N3O6.C28H19N2O.C23H19N2O.C21H21N2O.6Ir/c1-32-28-40(35-18-7-4-8-19-35)47(41(29-32)36-20-9-5-10-21-36)50-31-43(46-33(2)16-15-17-34(46)3)49-48(50)37-26-27-45-42(30-37)39-24-13-14-25-44(39)51(45)38-22-11-6-12-23-38;36-25-18-19-32(33(37)22-25)35-38-20-21-39(35)34-30(28-14-5-10-23-8-1-3-12-26(23)28)16-7-17-31(34)29-15-6-11-24-9-2-4-13-27(24)29;1-23(21-35)13-14-34(6,22-33(4,5)31(38)41-8)32(39)43-18-17-42-28-19-24(2)29(25(3)20-28)37-16-15-36-30(37)26-9-11-27(40-7)12-10-26;1-19-8-7-12-22(20-9-3-2-4-10-20)27(19)30-17-16-29-28(30)21-14-15-26-24(18-21)23-11-5-6-13-25(23)31-26;1-17-7-6-10-21(18-8-4-3-5-9-18)22(17)25-16-15-24-23(25)19-11-13-20(26-2)14-12-19;1-14-11-15(2)20(16(3)12-14)23-9-8-22-21(23)18-6-7-19-17(13-18)5-4-10-24-19;;;;;;/h4-25,27-31H,1-3H3;1-18,20-22H;9,11-12,15-16,19-20,23H,13-14,17-18,22H2,1-8H3;2-13,15-18H,1H3;3-11,13-16H,1-2H3;7-9,11-13H,4-5,10H2,1-3H3;;;;;;/q6*-1
• InChIKey: MKUATOFCENJASF-UHFFFAOYSA-N
• XLogP: 45.16
• TPSA: 238.30 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 33
• Heavy Atoms: 220
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3960.73
LogP ≤ 5	45.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole?

The IUPAC name of 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole (CID 157060877) is 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole.

What is the SMILES notation for 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole?

The canonical SMILES for 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole is COC(=O)C(C)(C)CC(C)(CCC(C)C#N)C(=O)OCCOc1cc(C)c(-n2ccnc2-c2[c-]cc(OC)cc2)c(C)c1.COc1c[c-]c(-c2nccn2-c2c(C)cccc2-c2ccccc2)cc1.Cc1cc(-c2ccccc2)c(-n2cc(-c3c(C)cccc3C)nc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(-c2ccccc2)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)CCCO3)c(C)c1.Cc1cccc(-c2ccccc2)c1-n1ccnc1-c1[c-]cc2oc3ccccc3c2c1.Fc1c[c-]c(-c2nccn2-c2c(-c3cccc4ccccc34)cccc2-c2cccc3ccccc23)c(F)c1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole?

The InChIKey is MKUATOFCENJASF-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H36N3.C35H21F2N2.C34H42N3O6.C28H19N2O.C23H19N2O.C21H21N2O.6Ir/c1-32-28-40(35-18-7-4-8-19-35)47(41(29-32)36-20-9-5-10-21-36)50-31-43(46-33(2)16-15-17-34(46)3)49-48(50)37-26-27-45-42(30-37)39-24-13-14-25-44(39)51(45)38-22-11-6-12-23-38;36-25-18-19-32(33(37)22-25)35-38-20-21-39(35)34-30(28-14-5-10-23-8-1-3-12-26(23)28)16-7-17-31(34)29-15-6-11-24-9-2-4-13-27(24)29;1-23(21-35)13-14-34(6,22-33(4,5)31(38)41-8)32(39)43-18-17-42-28-19-24(2)29(25(3)20-28)37-16-15-36-30(37)26-9-11-27(40-7)12-10-26;1-19-8-7-12-22(20-9-3-2-4-10-20)27(19)30-17-16-29-28(30)21-14-15-26-24(18-21)23-11-5-6-13-25(23)31-26;1-17-7-6-10-21(18-8-4-3-5-9-18)22(17)25-16-15-24-23(25)19-11-13-20(26-2)14-12-19;1-14-11-15(2)20(16(3)12-14)23-9-8-22-21(23)18-6-7-19-17(13-18)5-4-10-24-19;;;;;;/h4-25,27-31H,1-3H3;1-18,20-22H;9,11-12,15-16,19-20,23H,13-14,17-18,22H2,1-8H3;2-13,15-18H,1H3;3-11,13-16H,1-2H3;7-9,11-13H,4-5,10H2,1-3H3;;;;;;/q6*-1;;;;;;.

What are the key properties of 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole?

2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole has a molecular weight of 3960.73 g/mol, XLogP of 45.16, 33 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(3H-dibenzofuran-3-id-2-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,4-difluorobenzene-6-id-1-yl)-1-(2,6-dinaphthalen-1-ylphenyl)imidazole;3-[4-(2,6-dimethylphenyl)-1-(4-methyl-2,6-diphenylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;hexakis(iridium);5-O-[2-[4-[2-(4-methoxybenzene-6-id-1-yl)imidazol-1-yl]-3,5-dimethylphenoxy]ethyl] 1-O-methyl 4-(3-cyanobutyl)-2,2,4-trimethylpentanedioate;2-(4-methoxybenzene-6-id-1-yl)-1-(2-methyl-6-phenylphenyl)imidazole;2-(2,3,4,7-tetrahydrochromen-7-id-6-yl)-1-(2,4,6-trimethylphenyl)imidazole is sourced from PubChem (CID 157060877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).