[4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane

C35H28N2OSi — CID 169293694

IUPAC[4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(-c2ccc3cc(-c4ccc(-c5ccc6oc7ccccc7c6c5)nc4)cnc3c2)cc1
InChIInChI=1S/C35H28N2OSi/c1-39(2,3)29-14-10-23(11-15-29)24-8-9-25-18-28(22-37-33(25)20-24)27-12-16-32(36-21-27)26-13-17-35-31(19-26)30-6-4-5-7-34(30)38-35/h4-22H,1-3H3
InChIKeyGYWQMGYEXQBYQZ-UHFFFAOYSA-N
MW520.71 g/mol
LogP9.08
Rot. Bonds4

About [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane

[4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane (PubChem CID 169293694) has the molecular formula C35H28N2OSi and a molecular weight of 520.71 g/mol. Its IUPAC name is [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane.

Molecular Properties

Compound Name[4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane
PubChem CID169293694
Molecular FormulaC35H28N2OSi
Molecular Weight520.71 g/mol
Exact Mass520.20
IUPAC Name[4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(-c2ccc3cc(-c4ccc(-c5ccc6oc7ccccc7c6c5)nc4)cnc3c2)cc1
InChIInChI=1S/C35H28N2OSi/c1-39(2,3)29-14-10-23(11-15-29)24-8-9-25-18-28(22-37-33(25)20-24)27-12-16-32(36-21-27)26-13-17-35-31(19-26)30-6-4-5-7-34(30)38-35/h4-22H,1-3H3
InChIKeyGYWQMGYEXQBYQZ-UHFFFAOYSA-N
XLogP9.08
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms39
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500520.71
LogP ≤ 59.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane?
The IUPAC name of [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane (CID 169293694) is [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane.
What is the SMILES notation for [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane?
The canonical SMILES for [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane is C[Si](C)(C)c1ccc(-c2ccc3cc(-c4ccc(-c5ccc6oc7ccccc7c6c5)nc4)cnc3c2)cc1.
What is the InChIKey of [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane?
The InChIKey is GYWQMGYEXQBYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H28N2OSi/c1-39(2,3)29-14-10-23(11-15-29)24-8-9-25-18-28(22-37-33(25)20-24)27-12-16-32(36-21-27)26-13-17-35-31(19-26)30-6-4-5-7-34(30)38-35/h4-22H,1-3H3.
What are the key properties of [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane?
[4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane has a molecular weight of 520.71 g/mol, XLogP of 9.08, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane is sourced from PubChem (CID 169293694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).