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

C70H64N4OPt-2 — CID 162448417

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

2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum (PubChem CID 162448417) has the molecular formula C70H64N4OPt-2 and a molecular weight of 1172.39 g/mol. Its IUPAC name is 2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum
• PubChem CID: 162448417
• Molecular Formula: C70H64N4OPt-2
• Molecular Weight: 1172.39 g/mol
• Exact Mass: 1171.47
• IUPAC Name: 2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2cc(-c4ccccc4)ccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3cc(-c4ccccc4)cc(C(C)(C)c4ccccc4)c3)c(C(C)(C)c3ccccc3)c2)c1.[Pt]
• InChI: InChI=1S/C70H64N4O.Pt/c1-67(2,3)54-35-36-71-66(43-54)74-63-34-31-50(48-23-15-11-16-24-48)39-62(63)61-33-32-59(45-64(61)74)75-60-42-55(68(4,5)6)40-57(44-60)72-46-65(70(9,10)53-29-21-14-22-30-53)73(47-72)58-38-51(49-25-17-12-18-26-49)37-56(41-58)69(7,8)52-27-19-13-20-28-52;/h11-43,46H,1-10H3;/q-2
• InChIKey: ZECLYFDASJEPPW-UHFFFAOYSA-N
• XLogP: 17.02
• TPSA: 35.86 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 11
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1172.39
LogP ≤ 5	17.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum (CID 162448417) is 2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2cc(-c4ccccc4)ccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3cc(-c4ccccc4)cc(C(C)(C)c4ccccc4)c3)c(C(C)(C)c3ccccc3)c2)c1.[Pt].

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

The InChIKey is ZECLYFDASJEPPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H64N4O.Pt/c1-67(2,3)54-35-36-71-66(43-54)74-63-34-31-50(48-23-15-11-16-24-48)39-62(63)61-33-32-59(45-64(61)74)75-60-42-55(68(4,5)6)40-57(44-60)72-46-65(70(9,10)53-29-21-14-22-30-53)73(47-72)58-38-51(49-25-17-12-18-26-49)37-56(41-58)69(7,8)52-27-19-13-20-28-52;/h11-43,46H,1-10H3;/q-2;.

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

2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum has a molecular weight of 1172.39 g/mol, XLogP of 17.02, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-tert-butyl-5-[3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-phenyl-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162448417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).