Sulfathiazole

C9H9N3O2S2CAS 72-14-0255.31 g/mol

Open in Covalent MOL file
H2NSOONHNS
Primary amineSulfonamide

Properties

Molecular formula
C9H9N3O2S2
Molar mass
255.31 g/mol
Exact mass
255.0136 Da
Density
1.53 g/mL
Melting point
202–202.5 °C
pKa
2.2, 7.24
Water solubility
373 mg/L (25 °C)
logP
1.53Crippen estimate
Polar surface area
85.1 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 86 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
72-14-0
SMILES
Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
InChIKey
JNMRHUJNCSQMMB-UHFFFAOYSA-N
InChI
InChI=1S/C9H9N3O2S2/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9/h1-6H,10H2,(H,11,12)

Weigh it out

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

Names and synonyms

49 names · show all
  • Benzenesulfonamide, 4-amino-N-2-thiazolyl-
  • Sulfanilamide, N1-2-thiazolyl-
  • Sulfanilamide, N1-4-thiazolin-2-ylidene-
  • 4-Amino-N-2-thiazolylbenzenesulfonamide
  • M&B 760
  • 2090 R.P.
  • Ciba 3714
  • 2-(p-Aminobenzenesulphonamido)thiazole
  • Azoseptale
  • Chemosept
  • Cibazol
  • Duatok
  • Eleudron
  • Neostrepsan
  • Norsulfasol
  • Norsulfazole
  • Planomide
  • Poliseptil
  • Streptosilthiazole
  • 2-Sulfanilamidothiazole
  • 2-(Sulfanilylamino)thiazole
  • Sulfathiazol
  • Sulphathiazole
  • Sulzol
  • Thiacoccine
  • Thiazamide
  • Thiozamide
  • Sulfanilamidothiazole
  • Norsulfazol
  • N1-(2-Thiazolyl)sulfanilamide
  • Estafilol
  • Azoquimiol
  • Thiasulfol
  • Dulana
  • Wintrazole
  • Sanotiazol
  • Sulfocerol
  • 2-(p-Aminobenzenesulfonamido)thiazole
  • 2-Sulfathiazole
  • Sulfavitina
  • M And B 760
  • Sulfamul
  • Enterobiocine
  • NSC 31812
  • NSC 683531
  • 4-[(1,3-Thiazol-2-yl)aminosulfonyl]aniline
  • N-(Thiazol-2-yl)-4-aminobenzenesulfonamide
  • 4-Amino-N-(1,3-thiazol-2-yl)benzenesulfonamide
  • p-Amino-N-(2-thiazolyl)benzenesulfonamide

Work with Sulfathiazole

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Sodium sulfathiazole144-74-1Salt

Similar compounds

Sulfadiazine68-35-956 % similar Sulfapyridine144-83-254 % similar Sulfamethizole144-82-153 % similar 4,4′-Diaminobenzenesulfonanilide16803-97-753 % similar Succinylsulfathiazole116-43-852 % similar 4-Amino-N-5-isoxazolylbenzenesulfonamide7758-79-450 % similar Phthalylsulfathiazole85-73-450 % similar Sulfamerazine127-79-749 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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