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Structure of 4923-01-7

Chemical Structure| 4923-01-7

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Product Details of [ 4923-01-7 ]

CAS No. :4923-01-7
Formula : C3H6N4
M.W : 98.11
SMILES Code : NC1=NN=C(C)N1
MDL No. :MFCD00498236
InChI Key :FJRZOOICEHBAED-UHFFFAOYSA-N
Pubchem ID :234610

Safety of [ 4923-01-7 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 4923-01-7 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 4923-01-7 ]

[ 4923-01-7 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 4923-01-7 ]
  • [ 25007-54-9 ]
  • [ 115761-40-5 ]
YieldReaction ConditionsOperation in experiment
In methanol; acetic acid; The (6R,7R)-7-(2-amino-4-thiazoleglyoxylamido)-3-[[[5-(hydroxycarbamoyl)-2-methyl-s-triazolo[1,5-a]pyrimidin-7-yl]thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid used as the starting material can be prepared as follows: 3-Amino-5-methyl-1H-s-triazole (112 mg) and 320 mg of dimethyl 2-oxo-succinate are dissolved in 5 ml of glacial acetic acid. After boiling under reflux for 22 hours the solvent is distilled off in a vacuum. The residue is suspended in warm methanol. After cooling the product is filtered off and washed several times with methanol. After drying in a high vacuum there are obtained 73 mg of methyl 7-hydroxy-2-methyl-s-triazolo[1,5-a]pyrimidine-5-carboxylate as a beige powder, m.p.>220 C. 1 H NMR (DMSOd6): signals at, inter alia, δ2.44 (s, 3H), 3.88 (s, 3H), 6.54 (s, 1H).
In methanol; acetic acid; The (6R,7R)-7-(2-amino-4-thiazoleglyoxylamido)-3-[[[5-(hydroxycarbamoyl)-2-methyl-s-triazolo[1,5-a]pyrimidin-7-yl]thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid used as the starting compound can be prepared as follows: 3-Amino-5-methyl-1H-s-triazole (112 mg) and 320 mg of dimethyl 2-oxo-succinate are dissolved in 5 ml of glacial acetic acid. After boiling under reflux for 22 hours the solvent is distilled off in a vacuum. The residue is suspended in warm methanol. After cooling the product is filtered off and washed several times with methanol. After drying in a high vacuum there are obtained 73 mg of methyl 7-hydroxy-2-methyl-s-triazolo[1,5-a]pyrimidine-5-carboxylate as a beige powder, m.p.>220 C. 1 H NMR (DMSO-d6): signals at, inter alia, δ2.44 (s, 3H), 3.88 (s, 3H), 6.54 (s, 1H).
  • 2
  • [ 4923-01-7 ]
  • [ 35144-22-0 ]
  • [ 41511-69-7 ]
YieldReaction ConditionsOperation in experiment
With potassium carbonate; In water; acetonitrile; EXAMPLE (II-2) STR716 A mixture of 11.2 g (0.06 mol) of 4,6-dimethyl-2-methylsulphonyl-pyrimidine, 5.9 g (0.06 mol) of 3-amino-5-methyl-1,2,4-triazole, 8.3 g (0.06 mol) of potassium carbonate and 100 ml of acetonitrile is boiled to reflux for 5 hours. After evaporating, the residue is stirred into 100 ml of water, the product, which in this process is obtained in the form of crystals, is isolated by filtering off with suction, washed with water and recrystallized from acetonitrile. 4.6 g (37% of theory) of 1-(4,6-dimethylpyrimidin-2-yl)-5-amino-3-methyl-1,2,4-triazole of melting point 237 C. are obtained.
 

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