5-Bromo-2-thiophenesulfonamide

C₄H₄BrNO₂S₂CAS 53595-65-6242.10 g/mol

Open in Covalent MOL file

Aryl halide Sulfonamide

Properties

Molecular formula: C₄H₄BrNO₂S₂
Molar mass: 242.10 g/mol
Exact mass: 240.8867 Da
logP: 1.16Crippen estimate
Polar surface area: 60.2 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

53595-65-6

SMILES

NS(=O)(=O)c1ccc(Br)s1

InChIKey

WXJQQLDICAOBJB-UHFFFAOYSA-N

InChI

InChI=1S/C4H4BrNO2S2/c5-3-1-2-4(9-3)10(6,7)8/h1-2H,(H2,6,7,8)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

2-Thiophenesulfonamide, 5-bromo-

Work with 5-Bromo-2-thiophenesulfonamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-Chloro-2-thiophenesulfonamide53595-66-755 % similar 5-Bromo-2-thiophenesulfonyl chloride55854-46-155 % similar 2,5-Dibromothiophene3141-27-344 % similar 2-Thiophenesulfonamide6339-87-344 % similar 4-Bromobenzenesulfonamide701-34-841 % similar Sulfanilamide63-74-138 % similar 5-Bromo-2-thiophenecarboxaldehyde4701-17-136 % similar 2-Bromo-5-chlorothiophene2873-18-935 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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