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

C58H57N4OPt-3 — CID 162448897

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

4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 162448897) has the molecular formula C58H57N4OPt-3 and a molecular weight of 1021.20 g/mol. Its IUPAC name is 4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 162448897
• Molecular Formula: C58H57N4OPt-3
• Molecular Weight: 1021.20 g/mol
• Exact Mass: 1020.42
• IUPAC Name: 4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1ccc(N2C=CN(c3[c-]c(Oc4[c-]c5c(c(C(C)(C)C)c4)c4ccccc4n5-c4cc(C(C)(C)c5ccccc5)ccn4)cc(C(C)(C)c4ccccc4)c3)[CH-]2)cc1.[Pt]
• InChI: InChI=1S/C58H57N4O.Pt/c1-55(2,3)40-25-27-45(28-26-40)60-31-32-61(39-60)46-33-44(58(9,10)42-21-15-12-16-22-42)34-47(36-46)63-48-37-50(56(4,5)6)54-49-23-17-18-24-51(49)62(52(54)38-48)53-35-43(29-30-59-53)57(7,8)41-19-13-11-14-20-41;/h11-35,37,39H,1-10H3;/q-3
• InChIKey: YRKDFRCUCBKCSD-UHFFFAOYSA-N
• XLogP: 14.73
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 64
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1021.20
LogP ≤ 5	14.73
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 4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 162448897) is 4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccc(N2C=CN(c3[c-]c(Oc4[c-]c5c(c(C(C)(C)C)c4)c4ccccc4n5-c4cc(C(C)(C)c5ccccc5)ccn4)cc(C(C)(C)c4ccccc4)c3)[CH-]2)cc1.[Pt].

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

The InChIKey is YRKDFRCUCBKCSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H57N4O.Pt/c1-55(2,3)40-25-27-45(28-26-40)60-31-32-61(39-60)46-33-44(58(9,10)42-21-15-12-16-22-42)34-47(36-46)63-48-37-50(56(4,5)6)54-49-23-17-18-24-51(49)62(52(54)38-48)53-35-43(29-30-59-53)57(7,8)41-19-13-11-14-20-41;/h11-35,37,39H,1-10H3;/q-3;.

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

4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1021.20 g/mol, XLogP of 14.73, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-2-[3-[3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162448897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).