2-thiophen-2-ylsulfonylsulfonylthiophene

C8H6O4S4 — CID 141485126

IUPAC2-thiophen-2-ylsulfonylsulfonylthiophene
SMILESO=S(=O)(c1cccs1)S(=O)(=O)c1cccs1
InChIInChI=1S/C8H6O4S4/c9-15(10,7-3-1-5-13-7)16(11,12)8-4-2-6-14-8/h1-6H
InChIKeyAHAGRALMZKGZPA-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.97
Rot. Bonds3

About 2-thiophen-2-ylsulfonylsulfonylthiophene

2-thiophen-2-ylsulfonylsulfonylthiophene (PubChem CID 141485126) has the molecular formula C8H6O4S4 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2-thiophen-2-ylsulfonylsulfonylthiophene.

Molecular Properties

Compound Name2-thiophen-2-ylsulfonylsulfonylthiophene
PubChem CID141485126
Molecular FormulaC8H6O4S4
Molecular Weight294.40 g/mol
Exact Mass293.91
IUPAC Name2-thiophen-2-ylsulfonylsulfonylthiophene
SMILESO=S(=O)(c1cccs1)S(=O)(=O)c1cccs1
InChIInChI=1S/C8H6O4S4/c9-15(10,7-3-1-5-13-7)16(11,12)8-4-2-6-14-8/h1-6H
InChIKeyAHAGRALMZKGZPA-UHFFFAOYSA-N
XLogP1.97
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

thiophene-2-(18F)sulfonyl fluoride
CID 72736656
sodium thiophene-2-sulfonic acid
CID 54603046
2-(disulfanylsulfonyl)thiophene
CID 147186470
ethane;thiophene-2-sulfonyl chloride
CID 91564390
methyl thiophene-2-sulfonate
CID 56986285
N-fluorothiophene-2-sulfonamide
CID 175398216
methanol;thiophene-2-sulfonamide
CID 157397427
2-propan-2-ylsulfonylthiophene
CID 22953694
N-sulfonylthiophene-2-sulfonamide
CID 88522112
2-(difluoromethylsulfonyl)thiophene
CID 82076235
1-thiophen-2-ylsulfonylpiperidine
CID 765823
N'-hydroxythiophene-2-sulfonohydrazide
CID 67151955

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-ylsulfonylsulfonylthiophene?
The IUPAC name of 2-thiophen-2-ylsulfonylsulfonylthiophene (CID 141485126) is 2-thiophen-2-ylsulfonylsulfonylthiophene.
What is the SMILES notation for 2-thiophen-2-ylsulfonylsulfonylthiophene?
The canonical SMILES for 2-thiophen-2-ylsulfonylsulfonylthiophene is O=S(=O)(c1cccs1)S(=O)(=O)c1cccs1.
What is the InChIKey of 2-thiophen-2-ylsulfonylsulfonylthiophene?
The InChIKey is AHAGRALMZKGZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6O4S4/c9-15(10,7-3-1-5-13-7)16(11,12)8-4-2-6-14-8/h1-6H.
What are the key properties of 2-thiophen-2-ylsulfonylsulfonylthiophene?
2-thiophen-2-ylsulfonylsulfonylthiophene has a molecular weight of 294.40 g/mol, XLogP of 1.97, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-ylsulfonylsulfonylthiophene is sourced from PubChem (CID 141485126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).