(2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane

C30H25NOSi — CID 156675686

IUPAC(2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane
SMILESC[Si](C)(C)c1ccc2nc(-c3ccc4oc5ccccc5c4c3)cc(-c3ccccc3)c2c1
InChIInChI=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
InChIKeyIWSCIFUWRRHIJR-UHFFFAOYSA-N
MW443.62 g/mol
LogP8.01
Rot. Bonds3

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 CID156675686
Molecular FormulaC30H25NOSi
Molecular Weight443.62 g/mol
Exact Mass443.17
IUPAC Name(2-dibenzofuran-2-yl-4-phenylquinolin-6-yl)-trimethylsilane
SMILESC[Si](C)(C)c1ccc2nc(-c3ccc4oc5ccccc5c4c3)cc(-c3ccccc3)c2c1
InChIInChI=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
InChIKeyIWSCIFUWRRHIJR-UHFFFAOYSA-N
XLogP8.01
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms33
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.62
LogP ≤ 58.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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).