dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+)

C36H34N4PtSi — CID 167382544

About dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+)

dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+) (PubChem CID 167382544) has the molecular formula C36H34N4PtSi and a molecular weight of 745.86 g/mol. Its IUPAC name is dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+).

Molecular Properties

• Compound Name: dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+)
• PubChem CID: 167382544
• Molecular Formula: C36H34N4PtSi
• Molecular Weight: 745.86 g/mol
• Exact Mass: 745.22
• IUPAC Name: dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+)
• SMILES: CC(C)c1ccnc(-n2c3[c-]c([Si](C)(C)c4[c-]c(N5CN(C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[Pt+2]
• InChI: InChI=1S/C36H34N4Si.Pt/c1-25(2)26-19-20-37-36(21-26)40-32-14-7-6-13-30(32)31-18-17-29(23-35(31)40)41(4,5)28-12-10-11-27(22-28)39-24-38(3)33-15-8-9-16-34(33)39;/h6-21,25H,24H2,1-5H3;/q-2;+2
• InChIKey: JKYNNSHRRRIQTO-UHFFFAOYSA-N
• XLogP: 7.27
• TPSA: 24.30 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	745.86
LogP ≤ 5	7.27
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'}

Frequently Asked Questions

What is the IUPAC name of dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+)?

The IUPAC name of dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+) (CID 167382544) is dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+).

What is the SMILES notation for dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+)?

The canonical SMILES for dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+) is CC(C)c1ccnc(-n2c3[c-]c([Si](C)(C)c4[c-]c(N5CN(C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[Pt+2].

What is the InChIKey of dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+)?

The InChIKey is JKYNNSHRRRIQTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H34N4Si.Pt/c1-25(2)26-19-20-37-36(21-26)40-32-14-7-6-13-30(32)31-18-17-29(23-35(31)40)41(4,5)28-12-10-11-27(22-28)39-24-38(3)33-15-8-9-16-34(33)39;/h6-21,25H,24H2,1-5H3;/q-2;+2.

What are the key properties of dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+)?

dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+) has a molecular weight of 745.86 g/mol, XLogP of 7.27, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for dimethyl-[3-(3-methyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;platinum(2+) is sourced from PubChem (CID 167382544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).