chempirical

Sodium sulfamethoxazole

C10H10N3NaO3SCAS 4563-84-2275.26 g/mol

Open in Covalent MOL file
N−SOONH2NONa+
Primary amineSulfonamide

Properties

Molecular formula
C10H10N3NaO3S
Molar mass
275.26 g/mol
Exact mass
275.0341 Da
logP
0.99Crippen estimate
Polar surface area
98.2 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
3

Identifiers

CAS number
4563-84-2
SMILES
Cc1cc([N-]S(=O)(=O)c2ccc(N)cc2)no1.[Na+]
InChIKey
CFNQJJGJKVHAME-UHFFFAOYSA-N
InChI
InChI=1S/C10H11N3O3S.Na/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9;/h2-6H,11H2,1H3,(H,12,13);

Weigh it out

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

Names and synonyms

7 names
  • Benzenesulfonamide, 4-amino-N-(5-methyl-3-isoxazolyl)-, sodium salt (1:1)
  • Sulfanilamide, N1-(5-methyl-3-isoxazolyl)-, monosodium salt
  • Benzenesulfonamide, 4-amino-N-(5-methyl-3-isoxazolyl)-, monosodium salt
  • Sodium, [N1-(5-methyl-3-isoxazolyl)sulfanilamido]-
  • Sulfisomezole sodium
  • Sulfamethoxazole sodium salt
  • Sulfamethoxazole sodium

Work with Sodium sulfamethoxazole

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

Sulfadimidine sodium1981-58-456 % similar Sulfachloropyridazine sodium23282-55-552 % similar Sulfadimethoxine sodium1037-50-952 % similar Monosodium 2-sulfanilamido-4-methylpyrimidine127-58-250 % similar Sulfadiazine sodium547-32-050 % similar Sodium sulfathiazole144-74-147 % similar Sodium sulfacetamide127-56-045 % similar Silver sulfadiazine22199-08-241 % similar

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

Elsewhere

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