Sulfamethoxydiazine

C11H12N4O3SCAS 651-06-9280.30 g/mol

Open in Covalent MOL file
ONNHSOONH2N
EtherPrimary amineSulfonamide

Properties

Molecular formula
C11H12N4O3S
Molar mass
280.30 g/mol
Exact mass
280.0630 Da
Melting point
214–216 °C
logP
0.87Crippen estimate
Polar surface area
107.2 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
4

Hazards

Warning
Irritant (GHS07)

Aggregated from 69 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
651-06-9
SMILES
COc1cnc(NS(=O)(=O)c2ccc(N)cc2)nc1
InChIKey
GPTONYMQFTZPKC-UHFFFAOYSA-N
InChI
InChI=1S/C11H12N4O3S/c1-18-9-6-13-11(14-7-9)15-19(16,17)10-4-2-8(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)

Weigh it out

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

Names and synonyms

34 names · show all
  • Benzenesulfonamide, 4-amino-N-(5-methoxy-2-pyrimidinyl)-
  • Sulfanilamide, N1-(5-methoxy-2-pyrimidinyl)-
  • 4-Amino-N-(5-methoxy-2-pyrimidinyl)benzenesulfonamide
  • AHR 857
  • BAY 5400
  • 2-(4-Aminobenzenesulfonamido)-5-methoxypyrimidine
  • Bayrena
  • Durenat
  • Kiron
  • Methoxypyrimal
  • N1-(5-Methoxy-2-pyrimidinyl)sulfanilamide
  • 5-Methoxy-2-sulfanilamidopyrimidine
  • Sulfameter
  • Sulfamethoxine
  • Sulfamethoxydin
  • Sulfamethoxypyrimidine
  • Sulfametin
  • 2-Sulfanilamido-5-methoxypyrimidine
  • Sulla
  • Sulphamethoxydiazine
  • Sulphameter
  • Longasulf
  • SH 613
  • Berlicid
  • Kirocid
  • Ultrax
  • 2-Sulfa-5-methoxypyrimidine
  • Sulfametoxydiazine
  • I 2586
  • Kinecid
  • Sulfametorine
  • 5-Methoxysulfadiazine
  • NSC 683528
  • N-(5-Methoxypyrimidin-2-yl)-4-aminobenzenesulfonamide

Work with Sulfamethoxydiazine

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

Sulfadiazine68-35-960 % similar Sulfadoxine2447-57-655 % similar Sulfamethazine57-68-152 % similar Sulfamerazine127-79-752 % similar Sulfadimethoxine122-11-252 % similar 4,4′-Diaminobenzenesulfonanilide16803-97-749 % similar 4-Methoxybenzenesulfonic acid hydrazide1950-68-148 % similar Sulfapyridine144-83-247 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Sulfamonomethoxine1220-83-3 Sulfalene152-47-6 Sulfamethoxypyridazine80-35-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook