5-thiophen-2-ylsulfonylthiophene-2-sulfonamide

C8H7NO4S4 — CID 4116214

IUPAC5-thiophen-2-ylsulfonylthiophene-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(S(=O)(=O)c2cccs2)s1
InChIInChI=1S/C8H7NO4S4/c9-17(12,13)8-4-3-7(15-8)16(10,11)6-2-1-5-14-6/h1-5H,(H2,9,12,13)
InChIKeyPKSPQYUQOOXIOO-UHFFFAOYSA-N
MW309.41 g/mol
LogP1.29
Rot. Bonds3

About 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide

5-thiophen-2-ylsulfonylthiophene-2-sulfonamide (PubChem CID 4116214) has the molecular formula C8H7NO4S4 and a molecular weight of 309.41 g/mol. Its IUPAC name is 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-thiophen-2-ylsulfonylthiophene-2-sulfonamide
PubChem CID4116214
Molecular FormulaC8H7NO4S4
Molecular Weight309.41 g/mol
Exact Mass308.93
IUPAC Name5-thiophen-2-ylsulfonylthiophene-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(S(=O)(=O)c2cccs2)s1
InChIInChI=1S/C8H7NO4S4/c9-17(12,13)8-4-3-7(15-8)16(10,11)6-2-1-5-14-6/h1-5H,(H2,9,12,13)
InChIKeyPKSPQYUQOOXIOO-UHFFFAOYSA-N
XLogP1.29
TPSA94.30 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide?
The IUPAC name of 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide (CID 4116214) is 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide.
What is the SMILES notation for 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide?
The canonical SMILES for 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide is NS(=O)(=O)c1ccc(S(=O)(=O)c2cccs2)s1.
What is the InChIKey of 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide?
The InChIKey is PKSPQYUQOOXIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NO4S4/c9-17(12,13)8-4-3-7(15-8)16(10,11)6-2-1-5-14-6/h1-5H,(H2,9,12,13).
What are the key properties of 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide?
5-thiophen-2-ylsulfonylthiophene-2-sulfonamide has a molecular weight of 309.41 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-ylsulfonylthiophene-2-sulfonamide is sourced from PubChem (CID 4116214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).