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N-(3,6-dichloropyridazin-4-yl)-4-fluorobenzenesulfonamide

HCID 57749426
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=S(=O)(Nc1cc(Cl)nnc1Cl)c1ccc(F)cc1
InChIKey
BXXZYOSRSMHYPA-UHFFFAOYSA-N
Molecular formula
C10H6Cl2FN3O2S
Average molar mass
322.14 g/mol
Monoisotopic mass
320.9541812

Names & identifiers

Preferred name
N-(3,6-dichloropyridazin-4-yl)-4-fluorobenzenesulfonamide
IUPAC
N-(3,6-dichloropyridazin-4-yl)-4-fluorobenzenesulfonamide

Names & synonyms

SCHEMBL2918440BXXZYOSRSMHYPA-UHFFFAOYSA-NDB-158944N-(3,6-dichloro-4-pyridazinyl)-4-fluorobenzenesulfonamideN-(3,6-dichloropyridazin-4-yl)-4-fluorobenzenesulfonamide1162681-01-7

Database identifiers

PubChem CID
57749426

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
80.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
398

Related reactions

4 records
New reaction record
HRID 180343 reaction equation
HRID 180343As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1162497 reaction equation
HRID 1162497As productuspto-grants-2010_10
HRID 1162498 reaction equation
HRID 1162498As reactantuspto-grants-2010_10
HRID 1229507 reaction equation
HRID 1229507As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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