2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran

C16H10O3S — CID 134849269

IUPAC2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran
SMILESO=S(c1cc2ccccc2o1)c1cc2ccccc2o1
InChIInChI=1S/C16H10O3S/c17-20(15-9-11-5-1-3-7-13(11)18-15)16-10-12-6-2-4-8-14(12)19-16/h1-10H
InChIKeyLZFPCFPYXPQPIB-UHFFFAOYSA-N
MW282.32 g/mol
LogP4.35
Rot. Bonds2

About 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran

2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran (PubChem CID 134849269) has the molecular formula C16H10O3S and a molecular weight of 282.32 g/mol. Its IUPAC name is 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran.

Molecular Properties

Compound Name2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran
PubChem CID134849269
Molecular FormulaC16H10O3S
Molecular Weight282.32 g/mol
Exact Mass282.04
IUPAC Name2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran
SMILESO=S(c1cc2ccccc2o1)c1cc2ccccc2o1
InChIInChI=1S/C16H10O3S/c17-20(15-9-11-5-1-3-7-13(11)18-15)16-10-12-6-2-4-8-14(12)19-16/h1-10H
InChIKeyLZFPCFPYXPQPIB-UHFFFAOYSA-N
XLogP4.35
TPSA43.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-Benzofuran-2-Sulfonamide
CID 10750432
4-(1-Benzofuran-2-yl)benzenesulfonamide
CID 127029022
1-Benzofuran-2-yl(2-thienyl)methanone
CID 684173
Dibenzofuran-2-sulphonic acid
CID 522803
2-Methyl-5-{3-[4-(methylsulfinyl)phenyl]-1-benzothiophen-5-yl}-1,3,4-oxadiazole
CID 45482691
2-(4-Fluorophenyl)-3-(4-methylsulfonylphenyl)-1-benzofuran
CID 155536520
1-(1-Benzofuran-2-yl)-2-(phenylsulfonyl)ethanone
CID 15146467
Benzofuran, 2,2'-methylenebis-
CID 3010578
8-Oxatricyclo(7.4.0.0,2,7)trideca-1(9),2(7),3,5,10,12-hexaene-4-sulfonyl chloride
CID 2758030
3,5-Bis(4-methoxyphenyl)-2-thiophen-3-yl-1-benzofuran
CID 24747884
5-(4-Methoxyphenyl)-2-thiophen-3-yl-1-benzofuran
CID 24746764
3-Thiophen-3-yl-1-benzofuran
CID 54184853

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran?
The IUPAC name of 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran (CID 134849269) is 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran.
What is the SMILES notation for 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran?
The canonical SMILES for 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran is O=S(c1cc2ccccc2o1)c1cc2ccccc2o1.
What is the InChIKey of 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran?
The InChIKey is LZFPCFPYXPQPIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10O3S/c17-20(15-9-11-5-1-3-7-13(11)18-15)16-10-12-6-2-4-8-14(12)19-16/h1-10H.
What are the key properties of 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran?
2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran has a molecular weight of 282.32 g/mol, XLogP of 4.35, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzofuran-2-ylsulfinyl)-1-benzofuran is sourced from PubChem (CID 134849269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).