2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide

C178H143N20O5Pt5-5 — CID 165090219

About 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide

2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide (PubChem CID 165090219) has the molecular formula C178H143N20O5Pt5-5 and a molecular weight of 3620.65 g/mol. Its IUPAC name is 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide.

Molecular Properties

• Compound Name: 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide
• PubChem CID: 165090219
• Molecular Formula: C178H143N20O5Pt5-5
• Molecular Weight: 3620.65 g/mol
• Exact Mass: 3618.00
• IUPAC Name: 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide
• SMILES: CC(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[cH+]n(C(C)(C)C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.CC(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[cH+]n(C(C)C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.CC(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[cH+]n(C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.Cc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[cH+]n(-c6ccccc6)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[2H]C([2H])([2H])n1[cH+]n(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)C)ccn3)ccc2)c2ccccc21.[Pt].[Pt].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C37H25N4O.C37H33N4O.C36H31N4O.2C34H27N4O.5Pt/c1-26-20-21-38-37(22-26)41-33-15-6-5-14-31(33)32-19-18-30(24-36(32)41)42-29-13-9-12-28(23-29)40-25-39(27-10-3-2-4-11-27)34-16-7-8-17-35(34)40;1-25(2)26-19-20-38-36(21-26)41-32-14-7-6-13-30(32)31-18-17-29(23-35(31)41)42-28-12-10-11-27(22-28)39-24-40(37(3,4)5)34-16-9-8-15-33(34)39;1-24(2)26-18-19-37-36(20-26)40-32-13-6-5-12-30(32)31-17-16-29(22-35(31)40)41-28-11-9-10-27(21-28)39-23-38(25(3)4)33-14-7-8-15-34(33)39;2*1-23(2)24-17-18-35-34(19-24)38-30-12-5-4-11-28(30)29-16-15-27(21-33(29)38)39-26-10-8-9-25(20-26)37-22-36(3)31-13-6-7-14-32(31)37;;;;;/h2-22,25H,1H3;6-21,24-25H,1-5H3;5-20,23-25H,1-4H3;2*4-19,22-23H,1-3H3;;;;;/q5*-1;;;;;/i;;;3D3
• InChIKey: OMQOSSZEHOZXHG-XDLNSROSSA-N
• XLogP: 44.18
• TPSA: 184.55 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 27
• Heavy Atoms: 208
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3620.65
LogP ≤ 5	44.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide?

The IUPAC name of 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide (CID 165090219) is 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide.

What is the SMILES notation for 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide?

The canonical SMILES for 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide is CC(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[cH+]n(C(C)(C)C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.CC(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[cH+]n(C(C)C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.CC(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[cH+]n(C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.Cc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[cH+]n(-c6ccccc6)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[2H]C([2H])([2H])n1[cH+]n(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)C)ccn3)ccc2)c2ccccc21.[Pt].[Pt].[Pt].[Pt].[Pt].

What is the InChIKey of 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide?

The InChIKey is OMQOSSZEHOZXHG-XDLNSROSSA-N. The full InChI is InChI=1S/C37H25N4O.C37H33N4O.C36H31N4O.2C34H27N4O.5Pt/c1-26-20-21-38-37(22-26)41-33-15-6-5-14-31(33)32-19-18-30(24-36(32)41)42-29-13-9-12-28(23-29)40-25-39(27-10-3-2-4-11-27)34-16-7-8-17-35(34)40;1-25(2)26-19-20-38-36(21-26)41-32-14-7-6-13-30(32)31-18-17-29(23-35(31)41)42-28-12-10-11-27(22-28)39-24-40(37(3,4)5)34-16-9-8-15-33(34)39;1-24(2)26-18-19-37-36(20-26)40-32-13-6-5-12-30(32)31-17-16-29(22-35(31)40)41-28-11-9-10-27(21-28)39-23-38(25(3)4)33-14-7-8-15-34(33)39;2*1-23(2)24-17-18-35-34(19-24)38-30-12-5-4-11-28(30)29-16-15-27(21-33(29)38)39-26-10-8-9-25(20-26)37-22-36(3)31-13-6-7-14-32(31)37;;;;;/h2-22,25H,1H3;6-21,24-25H,1-5H3;5-20,23-25H,1-4H3;2*4-19,22-23H,1-3H3;;;;;/q5*-1;;;;;/i;;;3D3;;;;;;.

What are the key properties of 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide?

2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide has a molecular weight of 3620.65 g/mol, XLogP of 44.18, 27 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-(3-tert-butyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]oxy-9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-propan-2-yl-2-pyridinyl)-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide is sourced from PubChem (CID 165090219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).