imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide

C4H4N4O2S2 — CID 23114444

IUPACimidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide
SMILESNS(=O)(=O)c1nn2ccnc2s1
InChIInChI=1S/C4H4N4O2S2/c5-12(9,10)4-7-8-2-1-6-3(8)11-4/h1-2H,(H2,5,9,10)
InChIKeyKZTCHLRGBAMGBG-UHFFFAOYSA-N
MW204.24 g/mol
LogP-0.56
Rot. Bonds1

About imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide

imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide (PubChem CID 23114444) has the molecular formula C4H4N4O2S2 and a molecular weight of 204.24 g/mol. Its IUPAC name is imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide.

Molecular Properties

Compound Nameimidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide
PubChem CID23114444
Molecular FormulaC4H4N4O2S2
Molecular Weight204.24 g/mol
Exact Mass203.98
IUPAC Nameimidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide
SMILESNS(=O)(=O)c1nn2ccnc2s1
InChIInChI=1S/C4H4N4O2S2/c5-12(9,10)4-7-8-2-1-6-3(8)11-4/h1-2H,(H2,5,9,10)
InChIKeyKZTCHLRGBAMGBG-UHFFFAOYSA-N
XLogP-0.56
TPSA90.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.24
LogP ≤ 5-0.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide?
The IUPAC name of imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide (CID 23114444) is imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide.
What is the SMILES notation for imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide?
The canonical SMILES for imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide is NS(=O)(=O)c1nn2ccnc2s1.
What is the InChIKey of imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide?
The InChIKey is KZTCHLRGBAMGBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N4O2S2/c5-12(9,10)4-7-8-2-1-6-3(8)11-4/h1-2H,(H2,5,9,10).
What are the key properties of imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide?
imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide has a molecular weight of 204.24 g/mol, XLogP of -0.56, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide is sourced from PubChem (CID 23114444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).