triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane

C52H40N2Si2 — CID 177296299

IUPACtriphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cn4)cc3)nc2)cc1
InChIInChI=1S/C52H40N2Si2/c1-7-19-43(20-8-1)55(44-21-9-2-10-22-44,45-23-11-3-12-24-45)49-35-37-51(53-39-49)41-31-33-42(34-32-41)52-38-36-50(40-54-52)56(46-25-13-4-14-26-46,47-27-15-5-16-28-47)48-29-17-6-18-30-48/h1-40H
InChIKeyLCOHSADQUFNVJJ-UHFFFAOYSA-N
MW749.08 g/mol
LogP6.57
Rot. Bonds10

About triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane

triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane (PubChem CID 177296299) has the molecular formula C52H40N2Si2 and a molecular weight of 749.08 g/mol. Its IUPAC name is triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane.

Molecular Properties

Compound Nametriphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane
PubChem CID177296299
Molecular FormulaC52H40N2Si2
Molecular Weight749.08 g/mol
Exact Mass748.27
IUPAC Nametriphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cn4)cc3)nc2)cc1
InChIInChI=1S/C52H40N2Si2/c1-7-19-43(20-8-1)55(44-21-9-2-10-22-44,45-23-11-3-12-24-45)49-35-37-51(53-39-49)41-31-33-42(34-32-41)52-38-36-50(40-54-52)56(46-25-13-4-14-26-46,47-27-15-5-16-28-47)48-29-17-6-18-30-48/h1-40H
InChIKeyLCOHSADQUFNVJJ-UHFFFAOYSA-N
XLogP6.57
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms56
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500749.08
LogP ≤ 56.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane?
The IUPAC name of triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane (CID 177296299) is triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane.
What is the SMILES notation for triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane?
The canonical SMILES for triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane is c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cn4)cc3)nc2)cc1.
What is the InChIKey of triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane?
The InChIKey is LCOHSADQUFNVJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H40N2Si2/c1-7-19-43(20-8-1)55(44-21-9-2-10-22-44,45-23-11-3-12-24-45)49-35-37-51(53-39-49)41-31-33-42(34-32-41)52-38-36-50(40-54-52)56(46-25-13-4-14-26-46,47-27-15-5-16-28-47)48-29-17-6-18-30-48/h1-40H.
What are the key properties of triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane?
triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane has a molecular weight of 749.08 g/mol, XLogP of 6.57, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[6-[4-(5-triphenylsilyl-2-pyridinyl)phenyl]-3-pyridinyl]silane is sourced from PubChem (CID 177296299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).