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

C65H65N4OPt-3 — CID 155650943

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

2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (PubChem CID 155650943) has the molecular formula C65H65N4OPt-3 and a molecular weight of 1113.34 g/mol. Its IUPAC name is 2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• PubChem CID: 155650943
• Molecular Formula: C65H65N4OPt-3
• Molecular Weight: 1113.34 g/mol
• Exact Mass: 1112.48
• IUPAC Name: 2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• SMILES: CC(C)c1ccccc1-c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cccc(-c4c(C(C)C)cccc4C(C)C)c3)c3ccc(C(C)(C)C)cc32)c1.[Pt]
• InChI: InChI=1S/C65H65N4O.Pt/c1-41(2)52-21-13-14-22-55(52)45-34-49(38-51(35-45)70-50-28-29-57-56-23-15-16-26-58(56)69(60(57)39-50)62-37-47(31-32-66-62)65(10,11)12)68-40-67(59-30-27-46(36-61(59)68)64(7,8)9)48-20-17-19-44(33-48)63-53(42(3)4)24-18-25-54(63)43(5)6;/h13-37,40-43H,1-12H3;/q-3
• InChIKey: WZPSXLNBRSFQHV-UHFFFAOYSA-N
• XLogP: 18.28
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 71
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1113.34
LogP ≤ 5	18.28
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 2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (CID 155650943) is 2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is CC(C)c1ccccc1-c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cccc(-c4c(C(C)C)cccc4C(C)C)c3)c3ccc(C(C)(C)C)cc32)c1.[Pt].

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

The InChIKey is WZPSXLNBRSFQHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H65N4O.Pt/c1-41(2)52-21-13-14-22-55(52)45-34-49(38-51(35-45)70-50-28-29-57-56-23-15-16-26-58(56)69(60(57)39-50)62-37-47(31-32-66-62)65(10,11)12)68-40-67(59-30-27-46(36-61(59)68)64(7,8)9)48-20-17-19-44(33-48)63-53(42(3)4)24-18-25-54(63)43(5)6;/h13-37,40-43H,1-12H3;/q-3;.

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

2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum has a molecular weight of 1113.34 g/mol, XLogP of 18.28, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[6-tert-butyl-3-[3-[2,6-di(propan-2-yl)phenyl]phenyl]-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 155650943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).