4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide

C7H8N6O2S2 — CID 114912916

IUPAC4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide
SMILESNNc1ccc(S(=O)(=O)Nc2nnns2)cc1
InChIInChI=1S/C7H8N6O2S2/c8-9-5-1-3-6(4-2-5)17(14,15)11-7-10-12-13-16-7/h1-4,9H,8H2,(H,10,11,13)
InChIKeyZETGIGNSKZBZPH-UHFFFAOYSA-N
MW272.31 g/mol
LogP0.02
Rot. Bonds4

About 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide

4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide (PubChem CID 114912916) has the molecular formula C7H8N6O2S2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide
PubChem CID114912916
Molecular FormulaC7H8N6O2S2
Molecular Weight272.31 g/mol
Exact Mass272.02
IUPAC Name4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide
SMILESNNc1ccc(S(=O)(=O)Nc2nnns2)cc1
InChIInChI=1S/C7H8N6O2S2/c8-9-5-1-3-6(4-2-5)17(14,15)11-7-10-12-13-16-7/h1-4,9H,8H2,(H,10,11,13)
InChIKeyZETGIGNSKZBZPH-UHFFFAOYSA-N
XLogP0.02
TPSA122.89 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(thiatriazol-5-ylsulfamoyl)benzoic acid
CID 114911956
2-hydrazinyl-N-(thiatriazol-5-yl)pyridine-4-sulfonamide
CID 114912904
4-(methylaminomethyl)-N-(thiatriazol-5-yl)benzenesulfonamide
CID 114912960
4-(4-hydroxybut-1-ynyl)-N-(thiatriazol-5-yl)benzenesulfonamide
CID 114913909
4-[1-(propylamino)ethyl]-N-(thiatriazol-5-yl)benzenesulfonamide
CID 114912868
6-(propylamino)-N-(thiatriazol-5-yl)pyridine-3-sulfonamide
CID 114914131
4-amino-2-fluoro-N-(thiatriazol-5-yl)benzenesulfonamide
CID 114911741
2-amino-5-chloro-N-(thiatriazol-5-yl)benzenesulfonamide
CID 114911766
4-hydrazinyl-2-methyl-5-nitro-N-(thiatriazol-5-yl)benzenesulfonamide
CID 114912915
4-hydrazinyl-N-(4-methylsulfanylphenyl)benzenesulfonamide
CID 43454843
3-methyl-4-(thiatriazol-5-ylsulfamoyl)benzenecarbothioamide
CID 106998596
3-(4-hydroxybut-1-ynyl)-N-(thiatriazol-5-yl)benzenesulfonamide
CID 114913929

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide?
The IUPAC name of 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide (CID 114912916) is 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide.
What is the SMILES notation for 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide?
The canonical SMILES for 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide is NNc1ccc(S(=O)(=O)Nc2nnns2)cc1.
What is the InChIKey of 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide?
The InChIKey is ZETGIGNSKZBZPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N6O2S2/c8-9-5-1-3-6(4-2-5)17(14,15)11-7-10-12-13-16-7/h1-4,9H,8H2,(H,10,11,13).
What are the key properties of 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide?
4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide has a molecular weight of 272.31 g/mol, XLogP of 0.02, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(thiatriazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 114912916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).