8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium

C60H48GeIrN4O2-2 — CID 156671353

About 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium

8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium (PubChem CID 156671353) has the molecular formula C60H48GeIrN4O2-2 and a molecular weight of 1126.93 g/mol. Its IUPAC name is 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium.

Molecular Properties

• Compound Name: 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium
• PubChem CID: 156671353
• Molecular Formula: C60H48GeIrN4O2-2
• Molecular Weight: 1126.93 g/mol
• Exact Mass: 1128.29
• IUPAC Name: 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium
• SMILES: [2H]C([2H])([2H])c1ccc(-c2c[c-]c(-c3nc4ccccc4n3-c3cccc4c3oc3ccccc34)c3oc4ncccc4c23)cc1.[2H]C([2H])(c1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C)C(C)c1ccccc1.[Ir]
• InChI: InChI=1S/C37H22N3O2.C23H26GeN.Ir/c1-22-15-17-23(18-16-22)24-19-20-28(35-33(24)27-10-7-21-38-37(27)42-35)36-39-29-11-3-4-12-30(29)40(36)31-13-6-9-26-25-8-2-5-14-32(25)41-34(26)31;1-18(19-11-7-5-8-12-19)15-21-16-23(20-13-9-6-10-14-20)25-17-22(21)24(2,3)4;/h2-19,21H,1H3;5-13,16-18H,15H2,1-4H3;/q2*-1;/i1D3;15D2
• InChIKey: UVVPQWBZPAICOP-JAPIFNDLSA-N
• XLogP: 15.10
• TPSA: 69.88 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 9
• Heavy Atoms: 68
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1126.93
LogP ≤ 5	15.10
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium?

The IUPAC name of 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium (CID 156671353) is 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium.

What is the SMILES notation for 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium?

The canonical SMILES for 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium is [2H]C([2H])([2H])c1ccc(-c2c[c-]c(-c3nc4ccccc4n3-c3cccc4c3oc3ccccc34)c3oc4ncccc4c23)cc1.[2H]C([2H])(c1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C)C(C)c1ccccc1.[Ir].

What is the InChIKey of 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium?

The InChIKey is UVVPQWBZPAICOP-JAPIFNDLSA-N. The full InChI is InChI=1S/C37H22N3O2.C23H26GeN.Ir/c1-22-15-17-23(18-16-22)24-19-20-28(35-33(24)27-10-7-21-38-37(27)42-35)36-39-29-11-3-4-12-30(29)40(36)31-13-6-9-26-25-8-2-5-14-32(25)41-34(26)31;1-18(19-11-7-5-8-12-19)15-21-16-23(20-13-9-6-10-14-20)25-17-22(21)24(2,3)4;/h2-19,21H,1H3;5-13,16-18H,15H2,1-4H3;/q2*-1;/i1D3;15D2;.

What are the key properties of 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium?

8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium has a molecular weight of 1126.93 g/mol, XLogP of 15.10, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-5-[4-(trideuteriomethyl)phenyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(1,1-dideuterio-2-phenylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;iridium is sourced from PubChem (CID 156671353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).