[9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum

C49H45N4OPtSi- — CID 162465192

About [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum

[9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum (PubChem CID 162465192) has the molecular formula C49H45N4OPtSi- and a molecular weight of 929.09 g/mol. Its IUPAC name is [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum.

Molecular Properties

• Compound Name: [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum
• PubChem CID: 162465192
• Molecular Formula: C49H45N4OPtSi-
• Molecular Weight: 929.09 g/mol
• Exact Mass: 928.30
• IUPAC Name: [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum
• SMILES: CC(C)c1cccc(C(C)C)c1-c1ccnc(-n2c3[c-]c([Si](C)(C)c4[c-]c(N5[OH+]N(c6ccccc6)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[Pt]
• InChI: InChI=1S/C49H44N4OSi.Pt/c1-33(2)40-21-15-22-41(34(3)4)49(40)35-28-29-50-48(30-35)51-44-23-11-10-20-42(44)43-27-26-39(32-47(43)51)55(5,6)38-19-14-18-37(31-38)53-46-25-13-12-24-45(46)52(54-53)36-16-8-7-9-17-36;/h7-30,33-34H,1-6H3;/q-2;/p+1
• InChIKey: UJGDWXLNNDLSJO-UHFFFAOYSA-O
• XLogP: 11.64
• TPSA: 37.10 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 8
• Heavy Atoms: 56
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	929.09
LogP ≤ 5	11.64
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': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum?

The IUPAC name of [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum (CID 162465192) is [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum.

What is the SMILES notation for [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum?

The canonical SMILES for [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum is CC(C)c1cccc(C(C)C)c1-c1ccnc(-n2c3[c-]c([Si](C)(C)c4[c-]c(N5[OH+]N(c6ccccc6)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[Pt].

What is the InChIKey of [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum?

The InChIKey is UJGDWXLNNDLSJO-UHFFFAOYSA-O. The full InChI is InChI=1S/C49H44N4OSi.Pt/c1-33(2)40-21-15-22-41(34(3)4)49(40)35-28-29-50-48(30-35)51-44-23-11-10-20-42(44)43-27-26-39(32-47(43)51)55(5,6)38-19-14-18-37(31-38)53-46-25-13-12-24-45(46)52(54-53)36-16-8-7-9-17-36;/h7-30,33-34H,1-6H3;/q-2;/p+1.

What are the key properties of [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum?

[9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum has a molecular weight of 929.09 g/mol, XLogP of 11.64, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [9-[4-[2,6-di(propan-2-yl)phenyl]-2-pyridinyl]-1H-carbazol-1-id-2-yl]-dimethyl-[3-(1-phenyl-2,1,3-benzoxadiazol-2-ium-3-yl)benzene-2-id-1-yl]silane;platinum is sourced from PubChem (CID 162465192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).