About (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane
(2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane (PubChem CID 156675686) has the molecular formula C30H25NOSi
and a molecular weight of 443.62 g/mol. Its IUPAC name is (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane.
Molecular Properties
| Compound Name | (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane |
| PubChem CID | 156675686 |
| Molecular Formula | C30H25NOSi |
| Molecular Weight | 443.62 g/mol |
| Exact Mass | 443.17 |
| IUPAC Name | (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane |
| SMILES | C[Si](C)(C)c1ccc2nc(-c3ccc4oc5ccccc5c4c3)cc(-c3ccccc3)c2c1 |
| InChI | InChI=1S/C30H25NOSi/c1-33(2,3)22-14-15-27-25(18-22)24(20-9-5-4-6-10-20)19-28(31-27)21-13-16-30-26(17-21)23-11-7-8-12-29(23)32-30/h4-19H,1-3H3 |
| InChIKey | IWSCIFUWRRHIJR-UHFFFAOYSA-N |
| XLogP | 8.01 |
| TPSA | 26.03 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 33 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 443.62 |
| LogP ≤ 5 | 8.01 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane?
The IUPAC name of (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane (CID 156675686) is (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane.
What is the SMILES notation for (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane?
The canonical SMILES for (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane is C[Si](C)(C)c1ccc2nc(-c3ccc4oc5ccccc5c4c3)cc(-c3ccccc3)c2c1.
What is the InChIKey of (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane?
The InChIKey is IWSCIFUWRRHIJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25NOSi/c1-33(2,3)22-14-15-27-25(18-22)24(20-9-5-4-6-10-20)19-28(31-27)21-13-16-30-26(17-21)23-11-7-8-12-29(23)32-30/h4-19H,1-3H3.
What are the key properties of (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane?
(2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane has a molecular weight of 443.62 g/mol, XLogP of 8.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane is sourced from PubChem (CID 156675686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).