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

C62H59N4OPt-3 — CID 155651092

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

2-[3-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (PubChem CID 155651092) has the molecular formula C62H59N4OPt-3 and a molecular weight of 1071.26 g/mol. Its IUPAC name is 2-[3-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• PubChem CID: 155651092
• Molecular Formula: C62H59N4OPt-3
• Molecular Weight: 1071.26 g/mol
• Exact Mass: 1070.44
• IUPAC Name: 2-[3-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• SMILES: CC(C)c1cccc(C(C)C)c1-c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3ccc(-c4ccccc4)c(C(C)(C)C)c3)c3ccccc32)c1.[Pt]
• InChI: InChI=1S/C62H59N4O.Pt/c1-40(2)49-22-18-23-50(41(3)4)60(49)43-33-46(65-39-64(56-25-16-17-26-57(56)65)45-27-29-51(42-19-12-11-13-20-42)54(37-45)62(8,9)10)36-48(34-43)67-47-28-30-53-52-21-14-15-24-55(52)66(58(53)38-47)59-35-44(31-32-63-59)61(5,6)7;/h11-35,37,39-41H,1-10H3;/q-3
• InChIKey: WBBRDYFSGOGXME-UHFFFAOYSA-N
• XLogP: 17.15
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 68
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1071.26
LogP ≤ 5	17.15
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-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (CID 155651092) is 2-[3-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]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-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The canonical SMILES for 2-[3-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is CC(C)c1cccc(C(C)C)c1-c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3ccc(-c4ccccc4)c(C(C)(C)C)c3)c3ccccc32)c1.[Pt].

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

The InChIKey is WBBRDYFSGOGXME-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H59N4O.Pt/c1-40(2)49-22-18-23-50(41(3)4)60(49)43-33-46(65-39-64(56-25-16-17-26-57(56)65)45-27-29-51(42-19-12-11-13-20-42)54(37-45)62(8,9)10)36-48(34-43)67-47-28-30-53-52-21-14-15-24-55(52)66(58(53)38-47)59-35-44(31-32-63-59)61(5,6)7;/h11-35,37,39-41H,1-10H3;/q-3;.

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

2-[3-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum has a molecular weight of 1071.26 g/mol, XLogP of 17.15, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[3-(3-tert-butyl-4-phenylphenyl)-2H-benzimidazol-2-id-1-yl]-5-[2,6-di(propan-2-yl)phenyl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 155651092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).