9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+)

C61H58N4OPt — CID 162447282

About 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+)

9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+) (PubChem CID 162447282) has the molecular formula C61H58N4OPt and a molecular weight of 1058.24 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+).

Molecular Properties

• Compound Name: 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+)
• PubChem CID: 162447282
• Molecular Formula: C61H58N4OPt
• Molecular Weight: 1058.24 g/mol
• Exact Mass: 1057.43
• IUPAC Name: 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+)
• SMILES: Cc1cc2c(cc1C)N(c1cccc(C(C)(C)c3ccccc3)c1)[CH-]N2c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)cc(-c2ccccc2C(C)C)c1.[CH3-].[Pt+4]
• InChI: InChI=1S/C60H55N4O.CH3.Pt/c1-39(2)50-22-13-14-23-51(50)42-32-47(63-38-62(56-30-40(3)41(4)31-57(56)63)46-21-17-20-45(34-46)60(8,9)43-18-11-10-12-19-43)36-49(33-42)65-48-26-27-53-52-24-15-16-25-54(52)64(55(53)37-48)58-35-44(28-29-61-58)59(5,6)7;;/h10-35,38-39H,1-9H3;1H3;/q-3;-1;+4
• InChIKey: FIHRYKOHFIXPAW-UHFFFAOYSA-N
• XLogP: 16.46
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1058.24
LogP ≤ 5	16.46
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+)?

The IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+) (CID 162447282) is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+).

What is the SMILES notation for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+)?

The canonical SMILES for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+) is Cc1cc2c(cc1C)N(c1cccc(C(C)(C)c3ccccc3)c1)[CH-]N2c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)cc(-c2ccccc2C(C)C)c1.[CH3-].[Pt+4].

What is the InChIKey of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+)?

The InChIKey is FIHRYKOHFIXPAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H55N4O.CH3.Pt/c1-39(2)50-22-13-14-23-51(50)42-32-47(63-38-62(56-30-40(3)41(4)31-57(56)63)46-21-17-20-45(34-46)60(8,9)43-18-11-10-12-19-43)36-49(33-42)65-48-26-27-53-52-24-15-16-25-54(52)64(55(53)37-48)58-35-44(28-29-61-58)59(5,6)7;;/h10-35,38-39H,1-9H3;1H3;/q-3;-1;+4.

What are the key properties of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+)?

9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+) has a molecular weight of 1058.24 g/mol, XLogP of 16.46, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[5,6-dimethyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;carbanide;platinum(4+) is sourced from PubChem (CID 162447282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).