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

C74H53F6N4OPt-3 — CID 172531353

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

2-[3-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (PubChem CID 172531353) has the molecular formula C74H53F6N4OPt-3 and a molecular weight of 1323.33 g/mol. Its IUPAC name is 2-[3-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• PubChem CID: 172531353
• Molecular Formula: C74H53F6N4OPt-3
• Molecular Weight: 1323.33 g/mol
• Exact Mass: 1322.38
• IUPAC Name: 2-[3-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6c(-c7c(F)cc(F)cc7F)cc(C(C)(C)C)cc6-c6c(F)cc(F)cc6F)c6ccccc65)cc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c4)ccc3c3ccccc32)c1.[Pt]
• InChI: InChI=1S/C74H53F6N4O.Pt/c1-73(2,3)50-27-28-81-69(36-50)84-65-22-14-13-21-57(65)58-26-25-55(42-68(58)84)85-56-33-49(48-30-46(44-17-9-7-10-18-44)29-47(31-48)45-19-11-8-12-20-45)32-54(41-56)82-43-83(67-24-16-15-23-66(67)82)72-59(70-61(77)37-52(75)38-62(70)78)34-51(74(4,5)6)35-60(72)71-63(79)39-53(76)40-64(71)80;/h7-40,43H,1-6H3;/q-3
• InChIKey: GEQASSLMKWCDQB-UHFFFAOYSA-N
• XLogP: 20.74
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1323.33
LogP ≤ 5	20.74
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-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (CID 172531353) is 2-[3-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[3-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6c(-c7c(F)cc(F)cc7F)cc(C(C)(C)C)cc6-c6c(F)cc(F)cc6F)c6ccccc65)cc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c4)ccc3c3ccccc32)c1.[Pt].

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

The InChIKey is GEQASSLMKWCDQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H53F6N4O.Pt/c1-73(2,3)50-27-28-81-69(36-50)84-65-22-14-13-21-57(65)58-26-25-55(42-68(58)84)85-56-33-49(48-30-46(44-17-9-7-10-18-44)29-47(31-48)45-19-11-8-12-20-45)32-54(41-56)82-43-83(67-24-16-15-23-66(67)82)72-59(70-61(77)37-52(75)38-62(70)78)34-51(74(4,5)6)35-60(72)71-63(79)39-53(76)40-64(71)80;/h7-40,43H,1-6H3;/q-3;.

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

2-[3-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum has a molecular weight of 1323.33 g/mol, XLogP of 20.74, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[3-[4-tert-butyl-2,6-bis(2,4,6-trifluorophenyl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-(3,5-diphenylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 172531353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).