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N-(6-(3-(Methylthio)phenyl)imidazo[1,2-b]pyridazin-2-yl)acetamide

HCID 44124751
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CSc1cccc(-c2ccc3nc(NC(C)=O)cn3n2)c1
InChIKey
LEXVFSSQSRHCDF-UHFFFAOYSA-N
Molecular formula
C15H14N4OS
Average molar mass
298.4 g/mol

Names & identifiers

Preferred name
N-(6-(3-(Methylthio)phenyl)imidazo[1,2-b]pyridazin-2-yl)acetamide
IUPAC
N-[6-(3-methylsulfanylphenyl)imidazo[1,2-b]pyridazin-2-yl]acetamide

Names & synonyms

SCHEMBL2920508LEXVFSSQSRHCDF-UHFFFAOYSA-NN-(6-(3-(Methylthio)phenyl)imidazo[1,2-b]pyridazin-2-yl)acetamide

Database identifiers

PubChem CID
44124751

Properties

Computed structural properties

XLogP
2
Topological polar surface area
84.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
381

Related reactions

2 records
New reaction record
HRID 179926 reaction equation
HRID 179926As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1162440 reaction equation
HRID 1162440As productuspto-grants-2010_10

Compound notes

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