(4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane

C36H26F2Si — CID 176748741

IUPAC(4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane
SMILESFc1ccc(-c2ccc([Si](c3ccccc3)(c3ccc(F)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C36H26F2Si/c37-31-17-11-28(12-18-31)30-15-23-35(24-16-30)39(33-9-5-2-6-10-33,36-25-19-32(38)20-26-36)34-21-13-29(14-22-34)27-7-3-1-4-8-27/h1-26H
InChIKeyMPUAYLWGGXACSI-UHFFFAOYSA-N
MW524.69 g/mol
LogP6.68
Rot. Bonds6

About (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane

(4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane (PubChem CID 176748741) has the molecular formula C36H26F2Si and a molecular weight of 524.69 g/mol. Its IUPAC name is (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane.

Molecular Properties

Compound Name(4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane
PubChem CID176748741
Molecular FormulaC36H26F2Si
Molecular Weight524.69 g/mol
Exact Mass524.18
IUPAC Name(4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane
SMILESFc1ccc(-c2ccc([Si](c3ccccc3)(c3ccc(F)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C36H26F2Si/c37-31-17-11-28(12-18-31)30-15-23-35(24-16-30)39(33-9-5-2-6-10-33,36-25-19-32(38)20-26-36)34-21-13-29(14-22-34)27-7-3-1-4-8-27/h1-26H
InChIKeyMPUAYLWGGXACSI-UHFFFAOYSA-N
XLogP6.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.69
LogP ≤ 56.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane?
The IUPAC name of (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane (CID 176748741) is (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane.
What is the SMILES notation for (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane?
The canonical SMILES for (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane is Fc1ccc(-c2ccc([Si](c3ccccc3)(c3ccc(F)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane?
The InChIKey is MPUAYLWGGXACSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26F2Si/c37-31-17-11-28(12-18-31)30-15-23-35(24-16-30)39(33-9-5-2-6-10-33,36-25-19-32(38)20-26-36)34-21-13-29(14-22-34)27-7-3-1-4-8-27/h1-26H.
What are the key properties of (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane?
(4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane has a molecular weight of 524.69 g/mol, XLogP of 6.68, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane is sourced from PubChem (CID 176748741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).