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

C75H77N4OPt-3 — CID 162449480

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

2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (PubChem CID 162449480) has the molecular formula C75H77N4OPt-3 and a molecular weight of 1245.55 g/mol. Its IUPAC name is 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• PubChem CID: 162449480
• Molecular Formula: C75H77N4OPt-3
• Molecular Weight: 1245.55 g/mol
• Exact Mass: 1244.58
• IUPAC Name: 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6cc(C(C)(C)c7ccccc7)cc(C(C)(C)c7ccccc7)c6)c6ccc(C(C)(C)C)cc65)cc(C(C)(C)c5ccccc5)c4)cc(C(C)(C)C)c3c3ccccc32)c1.[Pt]
• InChI: InChI=1S/C75H77N4O.Pt/c1-70(2,3)53-35-36-65-66(44-53)78(49-77(65)58-40-55(73(10,11)50-27-19-16-20-28-50)39-56(41-58)74(12,13)51-29-21-17-22-30-51)59-42-57(75(14,15)52-31-23-18-24-32-52)43-60(46-59)80-61-47-63(72(7,8)9)69-62-33-25-26-34-64(62)79(67(69)48-61)68-45-54(37-38-76-68)71(4,5)6;/h16-45,47,49H,1-15H3;/q-3
• InChIKey: AVYGSBYAWQVIAW-UHFFFAOYSA-N
• XLogP: 19.85
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 11
• Heavy Atoms: 81
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1245.55
LogP ≤ 5	19.85
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-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (CID 162449480) is 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6cc(C(C)(C)c7ccccc7)cc(C(C)(C)c7ccccc7)c6)c6ccc(C(C)(C)C)cc65)cc(C(C)(C)c5ccccc5)c4)cc(C(C)(C)C)c3c3ccccc32)c1.[Pt].

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

The InChIKey is AVYGSBYAWQVIAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H77N4O.Pt/c1-70(2,3)53-35-36-65-66(44-53)78(49-77(65)58-40-55(73(10,11)50-27-19-16-20-28-50)39-56(41-58)74(12,13)51-29-21-17-22-30-51)59-42-57(75(14,15)52-31-23-18-24-32-52)43-60(46-59)80-61-47-63(72(7,8)9)69-62-33-25-26-34-64(62)79(67(69)48-61)68-45-54(37-38-76-68)71(4,5)6;/h16-45,47,49H,1-15H3;/q-3;.

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

2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum has a molecular weight of 1245.55 g/mol, XLogP of 19.85, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162449480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).