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

C59H59N4OPt-3 — CID 162449145

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

2-[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 162449145) has the molecular formula C59H59N4OPt-3 and a molecular weight of 1035.23 g/mol. Its IUPAC name is 2-[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 162449145
• Molecular Formula: C59H59N4OPt-3
• Molecular Weight: 1035.23 g/mol
• Exact Mass: 1034.44
• IUPAC Name: 2-[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2cc(-c4ccccc4)ccc2n3-c2cc(C(C)(C)c3ccccc3)ccn2)[c-]c(N2C=CN(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)[CH-]2)c1.[Pt]
• InChI: InChI=1S/C59H59N4O.Pt/c1-56(2,3)44-31-45(57(4,5)6)33-47(32-44)61-28-29-62(39-61)48-34-46(58(7,8)9)35-50(37-48)64-49-23-24-51-52-30-41(40-18-14-12-15-19-40)22-25-53(52)63(54(51)38-49)55-36-43(26-27-60-55)59(10,11)42-20-16-13-17-21-42;/h12-36,39H,1-11H3;/q-3
• InChIKey: BUEGBWQVWADAPX-UHFFFAOYSA-N
• XLogP: 15.37
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 65
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1035.23
LogP ≤ 5	15.37
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-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 162449145) is 2-[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2cc(-c4ccccc4)ccc2n3-c2cc(C(C)(C)c3ccccc3)ccn2)[c-]c(N2C=CN(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)[CH-]2)c1.[Pt].

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

The InChIKey is BUEGBWQVWADAPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H59N4O.Pt/c1-56(2,3)44-31-45(57(4,5)6)33-47(32-44)61-28-29-62(39-61)48-34-46(58(7,8)9)35-50(37-48)64-49-23-24-51-52-30-41(40-18-14-12-15-19-40)22-25-53(52)63(54(51)38-49)55-36-43(26-27-60-55)59(10,11)42-20-16-13-17-21-42;/h12-36,39H,1-11H3;/q-3;.

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

2-[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1035.23 g/mol, XLogP of 15.37, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-imidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162449145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).