3-thiophen-3-ylsulfonylsulfonylthiophene

C8H6O4S4 — CID 101047717

IUPAC3-thiophen-3-ylsulfonylsulfonylthiophene
SMILESO=S(=O)(c1ccsc1)S(=O)(=O)c1ccsc1
InChIInChI=1S/C8H6O4S4/c9-15(10,7-1-3-13-5-7)16(11,12)8-2-4-14-6-8/h1-6H
InChIKeyZAUHYMJZKUFTPO-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.97
Rot. Bonds3

About 3-thiophen-3-ylsulfonylsulfonylthiophene

3-thiophen-3-ylsulfonylsulfonylthiophene (PubChem CID 101047717) has the molecular formula C8H6O4S4 and a molecular weight of 294.40 g/mol. Its IUPAC name is 3-thiophen-3-ylsulfonylsulfonylthiophene.

Molecular Properties

Compound Name3-thiophen-3-ylsulfonylsulfonylthiophene
PubChem CID101047717
Molecular FormulaC8H6O4S4
Molecular Weight294.40 g/mol
Exact Mass293.91
IUPAC Name3-thiophen-3-ylsulfonylsulfonylthiophene
SMILESO=S(=O)(c1ccsc1)S(=O)(=O)c1ccsc1
InChIInChI=1S/C8H6O4S4/c9-15(10,7-1-3-13-5-7)16(11,12)8-2-4-14-6-8/h1-6H
InChIKeyZAUHYMJZKUFTPO-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-3-sulfonamide
CID 1201388
lithium thiophene-3-sulfonate
CID 155092365
ethane;3-propan-2-ylsulfonylthiophene
CID 143985187
N,N-diethylethanamine;thiophene-3-sulfonamide
CID 157152983
methyl N-thiophen-3-ylsulfonylcarbamate
CID 23445473
N-(methanesulfonamidomethyl)thiophene-3-sulfonamide
CID 90789852
N-(4-chlorophenyl)thiophene-3-sulfonamide
CID 86220695
3,3-dimethyl-1-thiophen-3-ylsulfonylbutan-2-one
CID 102325654
3-(benzenesulfonylmethyl)thiophene
CID 14632150
3-(3-phenylprop-2-ynylsulfonyl)thiophene
CID 122402742
4-(thiophen-3-ylmethylsulfonyl)aniline
CID 61368603
N-cyclobutyl-N-phenylthiophene-3-sulfonamide
CID 166248781

Frequently Asked Questions

What is the IUPAC name of 3-thiophen-3-ylsulfonylsulfonylthiophene?
The IUPAC name of 3-thiophen-3-ylsulfonylsulfonylthiophene (CID 101047717) is 3-thiophen-3-ylsulfonylsulfonylthiophene.
What is the SMILES notation for 3-thiophen-3-ylsulfonylsulfonylthiophene?
The canonical SMILES for 3-thiophen-3-ylsulfonylsulfonylthiophene is O=S(=O)(c1ccsc1)S(=O)(=O)c1ccsc1.
What is the InChIKey of 3-thiophen-3-ylsulfonylsulfonylthiophene?
The InChIKey is ZAUHYMJZKUFTPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6O4S4/c9-15(10,7-1-3-13-5-7)16(11,12)8-2-4-14-6-8/h1-6H.
What are the key properties of 3-thiophen-3-ylsulfonylsulfonylthiophene?
3-thiophen-3-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 3-thiophen-3-ylsulfonylsulfonylthiophene is sourced from PubChem (CID 101047717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).