2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

C174H177N12O3Pt3-9 — CID 163563890

About 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 163563890) has the molecular formula C174H177N12O3Pt3-9 and a molecular weight of 3069.64 g/mol. Its IUPAC name is 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 163563890
• Molecular Formula: C174H177N12O3Pt3-9
• Molecular Weight: 3069.64 g/mol
• Exact Mass: 3067.31
• IUPAC Name: 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(-c5c(C(C)(C)C)cc(C(C)(C)C)cc5C(C)(C)C)ccn4)ccc3)c3ccccc32)cc(C(C)(C)C)c1.CC(C)(C)c1cccc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(-c5cc(C(C)(C)C)ccc5C(C)(C)C)ccn4)ccc3)c3ccccc32)c1.CCC(C)(CC)c1cc(C)c(-c2ccnc(-n3c4[c-]c(Oc5[c-]c(N6[CH-]N(c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7ccccc76)ccc5)ccc4c4ccccc43)c2)c(C)c1.[Pt].[Pt].[Pt]
• InChI: InChI=1S/C62H67N4O.C58H59N4O.C54H51N4O.3Pt/c1-58(2,3)41-32-42(59(4,5)6)34-45(33-41)65-39-64(53-25-18-19-26-54(53)65)44-21-20-22-46(37-44)67-47-27-28-49-48-23-16-17-24-52(48)66(55(49)38-47)56-31-40(29-30-63-56)57-50(61(10,11)12)35-43(60(7,8)9)36-51(57)62(13,14)15;1-12-58(11,13-2)43-29-38(3)55(39(4)30-43)40-27-28-59-54(31-40)62-50-22-15-14-21-48(50)49-26-25-47(36-53(49)62)63-46-20-18-19-44(35-46)60-37-61(52-24-17-16-23-51(52)60)45-33-41(56(5,6)7)32-42(34-45)57(8,9)10;1-52(2,3)37-16-14-17-39(31-37)56-35-57(49-23-13-12-22-48(49)56)40-18-15-19-41(33-40)59-42-25-26-44-43-20-10-11-21-47(43)58(50(44)34-42)51-30-36(28-29-55-51)45-32-38(53(4,5)6)24-27-46(45)54(7,8)9;;;/h16-36,39H,1-15H3;14-34,37H,12-13H2,1-11H3;10-32,35H,1-9H3;;;/q3*-3
• InChIKey: WOTFPTWOZBFKKV-UHFFFAOYSA-N
• XLogP: 47.60
• TPSA: 100.59 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 21
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3069.64
LogP ≤ 5	47.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

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-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 163563890) is 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The canonical SMILES for 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(-c5c(C(C)(C)C)cc(C(C)(C)C)cc5C(C)(C)C)ccn4)ccc3)c3ccccc32)cc(C(C)(C)C)c1.CC(C)(C)c1cccc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(-c5cc(C(C)(C)C)ccc5C(C)(C)C)ccn4)ccc3)c3ccccc32)c1.CCC(C)(CC)c1cc(C)c(-c2ccnc(-n3c4[c-]c(Oc5[c-]c(N6[CH-]N(c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7ccccc76)ccc5)ccc4c4ccccc43)c2)c(C)c1.[Pt].[Pt].[Pt].

What is the InChIKey of 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The InChIKey is WOTFPTWOZBFKKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H67N4O.C58H59N4O.C54H51N4O.3Pt/c1-58(2,3)41-32-42(59(4,5)6)34-45(33-41)65-39-64(53-25-18-19-26-54(53)65)44-21-20-22-46(37-44)67-47-27-28-49-48-23-16-17-24-52(48)66(55(49)38-47)56-31-40(29-30-63-56)57-50(61(10,11)12)35-43(60(7,8)9)36-51(57)62(13,14)15;1-12-58(11,13-2)43-29-38(3)55(39(4)30-43)40-27-28-59-54(31-40)62-50-22-15-14-21-48(50)49-26-25-47(36-53(49)62)63-46-20-18-19-44(35-46)60-37-61(52-24-17-16-23-51(52)60)45-33-41(56(5,6)7)32-42(34-45)57(8,9)10;1-52(2,3)37-16-14-17-39(31-37)56-35-57(49-23-13-12-22-48(49)56)40-18-15-19-41(33-40)59-42-25-26-44-43-20-10-11-21-47(43)58(50(44)34-42)51-30-36(28-29-55-51)45-32-38(53(4,5)6)24-27-46(45)54(7,8)9;;;/h16-36,39H,1-15H3;14-34,37H,12-13H2,1-11H3;10-32,35H,1-9H3;;;/q3*-3;;;.

What are the key properties of 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 3069.64 g/mol, XLogP of 47.60, 21 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,5-ditert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2,6-dimethyl-4-(3-methylpentan-3-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2,4,6-tritert-butylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 163563890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).