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4-bromo-3-chloro-N-(thiazol-2-yl)benzenesulfonamide

HCID 57551174
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=S(=O)(Nc1nccs1)c1ccc(Br)c(Cl)c1
InChIKey
VZDDFMRLWYZCHN-UHFFFAOYSA-N
Molecular formula
C9H6BrClN2O2S2
Average molar mass
353.6 g/mol

Names & identifiers

Preferred name
4-bromo-3-chloro-N-(thiazol-2-yl)benzenesulfonamide
IUPAC
4-bromo-3-chloro-N-(1,3-thiazol-2-yl)benzenesulfonamide

Names & synonyms

SCHEMBL709719SCHEMBL29668964VZDDFMRLWYZCHN-UHFFFAOYSA-N4-bromo-3-chloro-N-(thiazol-2-yl)benzenesulfonamide

Database identifiers

PubChem CID
57551174

Properties

Computed structural propertiesFilling in

XLogP
2.1
Topological polar surface area
95.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
362

Related reactions

2 records
New reaction record
HRID 801066 reaction equation
HRID 801066As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1644657 reaction equation
HRID 1644657As productuspto-grants-2012_02

Compound notes

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