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1-Propanesulfonamide, 3-((1,2,4)triazolo(1,5-b)pyridazin-6-ylthio)-

HCID 3073804
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Basic information

CAS
152537-81-0
Standard SMILES
NS(=O)(=O)CCCSc1ccc2ncnn2n1
InChIKey
XUKLLYAXWBEPEC-UHFFFAOYSA-N
Molecular formula
C8H11N5O2S2
Average molar mass
273.3 g/mol
Monoisotopic mass
273.03541696

Names & identifiers

Preferred name
1-Propanesulfonamide, 3-((1,2,4)triazolo(1,5-b)pyridazin-6-ylthio)-
IUPAC
3-([1,2,4]triazolo[1,5-b]pyridazin-6-ylsulfanyl)propane-1-sulfonamide

Names & synonyms

1-Propanesulfonamide, 3-((1,2,4)triazolo(1,5-b)pyridazin-6-ylthio)-6-(3-Sulfamoyl-1-propylthio)(1,2,4)triazolo(1,5-b)pyridazine152537-81-03-((1,2,4)Triazolo(1,5-b)pyridazin-6-ylthio)-1-propanesulfonamideDTXSID40165066RefChem:234578DTXCID2087557SCHEMBL83108263-[([1,2,4]Triazolo[1,5-b]pyridazin-6-yl)sulfanyl]propane-1-sulfonamide

Database identifiers

CAS
152537-81-0
PubChem CID
3073804
DTXSID
DTXSID40165066

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
137 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
17
Formal charge
0
Complexity
344

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Compound notes

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