5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium)

C94H78Ir4N6O2S-4 — CID 158347073

About 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium)

5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium) (PubChem CID 158347073) has the molecular formula C94H78Ir4N6O2S-4 and a molecular weight of 2124.63 g/mol. Its IUPAC name is 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium).

Molecular Properties

• Compound Name: 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium)
• PubChem CID: 158347073
• Molecular Formula: C94H78Ir4N6O2S-4
• Molecular Weight: 2124.63 g/mol
• Exact Mass: 2126.44
• IUPAC Name: 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium)
• SMILES: Cc1cc(-c2ccccc2)cc(C)c1-c1cc(-c2[c-]cccc2)no1.Cc1cc(-c2ccccc2)cc(C)c1-c1nnc(-c2[c-]cccc2)n1C.Cc1cc(-c2ccccc2)cc(C)c1-c1oc(-c2[c-]cccc2)nc1C.Cc1cc(-c2ccccc2)cc(C)c1-c1sc(-c2[c-]cccc2)nc1C.[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/C24H20NO.C24H20NS.C23H20N3.C23H18NO.4Ir/c2*1-16-14-21(19-10-6-4-7-11-19)15-17(2)22(16)23-18(3)25-24(26-23)20-12-8-5-9-13-20;1-16-14-20(18-10-6-4-7-11-18)15-17(2)21(16)23-25-24-22(26(23)3)19-12-8-5-9-13-19;1-16-13-20(18-9-5-3-6-10-18)14-17(2)23(16)22-15-21(24-25-22)19-11-7-4-8-12-19;;;;/h3*4-12,14-15H,1-3H3;3-11,13-15H,1-2H3;;;;/q4*-1
• InChIKey: VEXNAFVODFIQEQ-UHFFFAOYSA-N
• XLogP: 24.59
• TPSA: 95.66 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 12
• Heavy Atoms: 107
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2124.63
LogP ≤ 5	24.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium)?

The IUPAC name of 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium) (CID 158347073) is 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium).

What is the SMILES notation for 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium)?

The canonical SMILES for 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium) is Cc1cc(-c2ccccc2)cc(C)c1-c1cc(-c2[c-]cccc2)no1.Cc1cc(-c2ccccc2)cc(C)c1-c1nnc(-c2[c-]cccc2)n1C.Cc1cc(-c2ccccc2)cc(C)c1-c1oc(-c2[c-]cccc2)nc1C.Cc1cc(-c2ccccc2)cc(C)c1-c1sc(-c2[c-]cccc2)nc1C.[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium)?

The InChIKey is VEXNAFVODFIQEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20NO.C24H20NS.C23H20N3.C23H18NO.4Ir/c2*1-16-14-21(19-10-6-4-7-11-19)15-17(2)22(16)23-18(3)25-24(26-23)20-12-8-5-9-13-20;1-16-14-20(18-10-6-4-7-11-18)15-17(2)21(16)23-25-24-22(26(23)3)19-12-8-5-9-13-19;1-16-13-20(18-9-5-3-6-10-18)14-17(2)23(16)22-15-21(24-25-22)19-11-7-4-8-12-19;;;;/h3*4-12,14-15H,1-3H3;3-11,13-15H,1-2H3;;;;/q4*-1;;;;.

What are the key properties of 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium)?

5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium) has a molecular weight of 2124.63 g/mol, XLogP of 24.59, 12 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-oxazole;5-(2,6-dimethyl-4-phenylphenyl)-4-methyl-2-phenyl-1,3-thiazole;3-(2,6-dimethyl-4-phenylphenyl)-4-methyl-5-phenyl-1,2,4-triazole;5-(2,6-dimethyl-4-phenylphenyl)-3-phenyl-1,2-oxazole;tetrakis(iridium) is sourced from PubChem (CID 158347073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).