[4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane

C37H30OSi — CID 169293942

IUPAC[4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(-c2ccc3ccc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3c2)cc1
InChIInChI=1S/C37H30OSi/c1-39(2,3)32-21-19-26(20-22-32)30-18-14-27-13-17-29(23-31(27)24-30)25-11-15-28(16-12-25)33-8-6-9-35-34-7-4-5-10-36(34)38-37(33)35/h4-24H,1-3H3
InChIKeyZMXIBAWMZJLTNN-UHFFFAOYSA-N
MW518.73 g/mol
LogP10.29
Rot. Bonds4

About [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane

[4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane (PubChem CID 169293942) has the molecular formula C37H30OSi and a molecular weight of 518.73 g/mol. Its IUPAC name is [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane.

Molecular Properties

Compound Name[4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane
PubChem CID169293942
Molecular FormulaC37H30OSi
Molecular Weight518.73 g/mol
Exact Mass518.21
IUPAC Name[4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(-c2ccc3ccc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3c2)cc1
InChIInChI=1S/C37H30OSi/c1-39(2,3)32-21-19-26(20-22-32)30-18-14-27-13-17-29(23-31(27)24-30)25-11-15-28(16-12-25)33-8-6-9-35-34-7-4-5-10-36(34)38-37(33)35/h4-24H,1-3H3
InChIKeyZMXIBAWMZJLTNN-UHFFFAOYSA-N
XLogP10.29
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.73
LogP ≤ 510.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran
CID 170289932
4-[4-[6-[4-(4-iodophenyl)phenyl]naphthalen-2-yl]phenyl]dibenzofuran
CID 170289926
N-(4-dibenzofuran-4-ylphenyl)-4-naphthalen-2-ylaniline
CID 155374295
2-dibenzofuran-4-yl-4-(4-naphthalen-2-ylnaphthalen-1-yl)-6-[4-(7-phenylnaphthalen-2-yl)naphthalen-1-yl]-1,3,5-triazine
CID 155481473
2-dibenzofuran-4-yl-4-(2-naphthalen-2-ylphenyl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 155480997
4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline
CID 88950712
N-(4-dibenzofuran-4-ylphenyl)-4-(3-naphthalen-2-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 155374400
2-(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 168850178
2-dibenzofuran-4-yl-4-(3-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 155481453
2-dibenzofuran-4-yl-4-naphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazine
CID 139441678
4-[4-(2,10-dinaphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran
CID 58323570
4-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 58510830

Frequently Asked Questions

What is the IUPAC name of [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane?
The IUPAC name of [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane (CID 169293942) is [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane.
What is the SMILES notation for [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane?
The canonical SMILES for [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane is C[Si](C)(C)c1ccc(-c2ccc3ccc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3c2)cc1.
What is the InChIKey of [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane?
The InChIKey is ZMXIBAWMZJLTNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H30OSi/c1-39(2,3)32-21-19-26(20-22-32)30-18-14-27-13-17-29(23-31(27)24-30)25-11-15-28(16-12-25)33-8-6-9-35-34-7-4-5-10-36(34)38-37(33)35/h4-24H,1-3H3.
What are the key properties of [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane?
[4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane has a molecular weight of 518.73 g/mol, XLogP of 10.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[7-(4-dibenzofuran-4-ylphenyl)naphthalen-2-yl]phenyl]-trimethylsilane is sourced from PubChem (CID 169293942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).