N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum

C70H53N5PtSi-2 — CID 171057297

About N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum

N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum (PubChem CID 171057297) has the molecular formula C70H53N5PtSi-2 and a molecular weight of 1197.45 g/mol. Its IUPAC name is N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum.

Molecular Properties

• Compound Name: N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum
• PubChem CID: 171057297
• Molecular Formula: C70H53N5PtSi-2
• Molecular Weight: 1197.45 g/mol
• Exact Mass: 1196.44
• IUPAC Name: N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum
• SMILES: [2H]c1c([2H])c([2H])c(-c2cccc(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2-[n+]2[c-]n(-c3[c-]c(N(c4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)[Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc3)c3ccccc32)c([2H])c1[2H].[Pt]
• InChI: InChI=1S/C70H53N5Si.Pt/c1-70(2,3)53-45-46-71-68(47-53)74-64-40-20-19-37-62(64)63-44-43-56(49-67(63)74)75(76(57-31-13-6-14-32-57,58-33-15-7-16-34-58)59-35-17-8-18-36-59)55-30-23-29-54(48-55)72-50-73(66-42-22-21-41-65(66)72)69-60(51-25-9-4-10-26-51)38-24-39-61(69)52-27-11-5-12-28-52;/h4-47H,1-3H3;/q-2;/i4D,5D,9D,10D,11D,12D,25D,26D,27D,28D
• InChIKey: HDAVRCPWRFVHPI-PNDUICBQSA-N
• XLogP: 14.23
• TPSA: 29.87 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 11
• Heavy Atoms: 77
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1197.45
LogP ≤ 5	14.23
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': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum?

The IUPAC name of N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum (CID 171057297) is N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum.

What is the SMILES notation for N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum?

The canonical SMILES for N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum is [2H]c1c([2H])c([2H])c(-c2cccc(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2-[n+]2[c-]n(-c3[c-]c(N(c4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)[Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc3)c3ccccc32)c([2H])c1[2H].[Pt].

What is the InChIKey of N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum?

The InChIKey is HDAVRCPWRFVHPI-PNDUICBQSA-N. The full InChI is InChI=1S/C70H53N5Si.Pt/c1-70(2,3)53-45-46-71-68(47-53)74-64-40-20-19-37-62(64)63-44-43-56(49-67(63)74)75(76(57-31-13-6-14-32-57,58-33-15-7-16-34-58)59-35-17-8-18-36-59)55-30-23-29-54(48-55)72-50-73(66-42-22-21-41-65(66)72)69-60(51-25-9-4-10-26-51)38-24-39-61(69)52-27-11-5-12-28-52;/h4-47H,1-3H3;/q-2;/i4D,5D,9D,10D,11D,12D,25D,26D,27D,28D;.

What are the key properties of N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum?

N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum has a molecular weight of 1197.45 g/mol, XLogP of 14.23, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-N-triphenylsilyl-1H-carbazol-1-id-2-amine;platinum is sourced from PubChem (CID 171057297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).