6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum

C74H75N4Pt-3 — CID 162448652

About 6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum

6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum (PubChem CID 162448652) has the molecular formula C74H75N4Pt-3 and a molecular weight of 1215.52 g/mol. Its IUPAC name is 6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 162448652
• Molecular Formula: C74H75N4Pt-3
• Molecular Weight: 1215.52 g/mol
• Exact Mass: 1214.57
• IUPAC Name: 6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1ccc(C(C)(C)c2ccnc(-n3c4[c-]c(C(c5[c-]c(N6[CH-]N(c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7ccccc76)ccc5)(c5ccccc5)c5ccccc5)ccc4c4cc(C(C)(C)C)ccc43)c2)cc1.[Pt]
• InChI: InChI=1S/C74H75N4.Pt/c1-69(2,3)50-32-34-51(35-33-50)73(13,14)55-40-41-75-68(48-55)78-64-39-37-54(70(4,5)6)46-63(64)62-38-36-57(47-67(62)78)74(52-24-17-15-18-25-52,53-26-19-16-20-27-53)56-28-23-29-60(43-56)76-49-77(66-31-22-21-30-65(66)76)61-44-58(71(7,8)9)42-59(45-61)72(10,11)12;/h15-42,44-46,48-49H,1-14H3;/q-3
• InChIKey: SUUUVIIRTCALCO-UHFFFAOYSA-N
• XLogP: 19.08
• TPSA: 24.30 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 79
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1215.52
LogP ≤ 5	19.08
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': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum (CID 162448652) is 6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccc(C(C)(C)c2ccnc(-n3c4[c-]c(C(c5[c-]c(N6[CH-]N(c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7ccccc76)ccc5)(c5ccccc5)c5ccccc5)ccc4c4cc(C(C)(C)C)ccc43)c2)cc1.[Pt].

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

The InChIKey is SUUUVIIRTCALCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H75N4.Pt/c1-69(2,3)50-32-34-51(35-33-50)73(13,14)55-40-41-75-68(48-55)78-64-39-37-54(70(4,5)6)46-63(64)62-38-36-57(47-67(62)78)74(52-24-17-15-18-25-52,53-26-19-16-20-27-53)56-28-23-29-60(43-56)76-49-77(66-31-22-21-30-65(66)76)61-44-58(71(7,8)9)42-59(45-61)72(10,11)12;/h15-42,44-46,48-49H,1-14H3;/q-3;.

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

6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1215.52 g/mol, XLogP of 19.08, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 6-tert-butyl-9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-2-[[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-diphenylmethyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162448652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).