2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine

C33H20FNS — CID 169293943

IUPAC2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine
SMILESFc1ccc(-c2ccc3cc(-c4ccc(-c5ccc6sc7ccccc7c6c5)nc4)ccc3c2)cc1
InChIInChI=1S/C33H20FNS/c34-28-13-9-21(10-14-28)22-5-6-24-18-25(8-7-23(24)17-22)27-11-15-31(35-20-27)26-12-16-33-30(19-26)29-3-1-2-4-32(29)36-33/h1-20H
InChIKeyHLWYODXOSWPZJF-UHFFFAOYSA-N
MW481.60 g/mol
LogP9.74
Rot. Bonds3

About 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine

2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine (PubChem CID 169293943) has the molecular formula C33H20FNS and a molecular weight of 481.60 g/mol. Its IUPAC name is 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine.

Molecular Properties

Compound Name2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine
PubChem CID169293943
Molecular FormulaC33H20FNS
Molecular Weight481.60 g/mol
Exact Mass481.13
IUPAC Name2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine
SMILESFc1ccc(-c2ccc3cc(-c4ccc(-c5ccc6sc7ccccc7c6c5)nc4)ccc3c2)cc1
InChIInChI=1S/C33H20FNS/c34-28-13-9-21(10-14-28)22-5-6-24-18-25(8-7-23(24)17-22)27-11-15-31(35-20-27)26-12-16-33-30(19-26)29-3-1-2-4-32(29)36-33/h1-20H
InChIKeyHLWYODXOSWPZJF-UHFFFAOYSA-N
XLogP9.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500481.60
LogP ≤ 59.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-dibenzothiophen-2-ylphenyl)-7-(4-fluorophenyl)quinoline
CID 169293677
2-dibenzofuran-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine
CID 169293876
5-dibenzothiophen-2-yl-2-[10-(4-phenylphenyl)anthracen-9-yl]pyridine
CID 153187941
6-[4-[6-[4-(4-fluorophenyl)phenyl]naphthalen-2-yl]phenyl]-[1]benzothiolo[2,3-b]pyridine
CID 169293735
2-[7-(4-fluorophenyl)dibenzothiophen-2-yl]pyridine
CID 166576691
3-(6-dibenzothiophen-4-yl-3-pyridinyl)-7-(4-fluorophenyl)quinoline
CID 169293933
2-dibenzothiophen-2-yl-5-[7-[3-ethyl-5-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine
CID 170294100
2-[4-(3-fluorophenyl)phenyl]dibenzothiophene
CID 170397972
3-[5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridinyl]quinoline
CID 169293981
[4-[4-(6-dibenzothiophen-2-ylnaphthalen-2-yl)phenyl]phenyl]-trimethylsilane
CID 171056497
3-(4-dibenzothiophen-2-ylphenyl)-1,10-phenanthroline
CID 90050319
3-(4-dibenzothiophen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline
CID 169293563

Frequently Asked Questions

What is the IUPAC name of 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine?
The IUPAC name of 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine (CID 169293943) is 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine.
What is the SMILES notation for 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine?
The canonical SMILES for 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine is Fc1ccc(-c2ccc3cc(-c4ccc(-c5ccc6sc7ccccc7c6c5)nc4)ccc3c2)cc1.
What is the InChIKey of 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine?
The InChIKey is HLWYODXOSWPZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H20FNS/c34-28-13-9-21(10-14-28)22-5-6-24-18-25(8-7-23(24)17-22)27-11-15-31(35-20-27)26-12-16-33-30(19-26)29-3-1-2-4-32(29)36-33/h1-20H.
What are the key properties of 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine?
2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine has a molecular weight of 481.60 g/mol, XLogP of 9.74, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzothiophen-2-yl-5-[6-(4-fluorophenyl)naphthalen-2-yl]pyridine is sourced from PubChem (CID 169293943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).