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

C70H50N4OPt-2 — CID 170539503

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

9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (PubChem CID 170539503) has the molecular formula C70H50N4OPt-2 and a molecular weight of 1158.28 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• PubChem CID: 170539503
• Molecular Formula: C70H50N4OPt-2
• Molecular Weight: 1158.28 g/mol
• Exact Mass: 1157.36
• IUPAC Name: 9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[c-][n+](-c6c(-c7ccccc7)cccc6-c6ccccc6)c6ccccc65)ccc4)c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)cc3c3ccccc32)c1.[Pt]
• InChI: InChI=1S/C70H50N4O.Pt/c1-70(2,3)55-38-39-71-68(43-55)74-63-35-17-16-32-60(63)62-45-61(54-41-52(48-22-8-4-9-23-48)40-53(42-54)49-24-10-5-11-25-49)67(46-66(62)74)75-57-31-20-30-56(44-57)72-47-73(65-37-19-18-36-64(65)72)69-58(50-26-12-6-13-27-50)33-21-34-59(69)51-28-14-7-15-29-51;/h4-43,45H,1-3H3;/q-2
• InChIKey: GHDHMBQICVZGAP-UHFFFAOYSA-N
• XLogP: 17.22
• TPSA: 35.86 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 10
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1158.28
LogP ≤ 5	17.22
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 9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (CID 170539503) is 9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[c-][n+](-c6c(-c7ccccc7)cccc6-c6ccccc6)c6ccccc65)ccc4)c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)cc3c3ccccc32)c1.[Pt].

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

The InChIKey is GHDHMBQICVZGAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H50N4O.Pt/c1-70(2,3)55-38-39-71-68(43-55)74-63-35-17-16-32-60(63)62-45-61(54-41-52(48-22-8-4-9-23-48)40-53(42-54)49-24-10-5-11-25-49)67(46-66(62)74)75-57-31-20-30-56(44-57)72-47-73(65-37-19-18-36-64(65)72)69-58(50-26-12-6-13-27-50)33-21-34-59(69)51-28-14-7-15-29-51;/h4-43,45H,1-3H3;/q-2;.

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

9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum has a molecular weight of 1158.28 g/mol, XLogP of 17.22, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-tert-butyl-2-pyridinyl)-3-(3,5-diphenylphenyl)-2-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 170539503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).