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[ CAS No. 251107-31-0 ]

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Chemical Structure| 251107-31-0
Chemical Structure| 251107-31-0
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Product Details of [ 251107-31-0 ]

CAS No. :251107-31-0 MDL No. :MFCD11520123
Formula : C12H16ClN Boiling Point : 310.8±22.0°C at 760 mmHg
Linear Structure Formula :- InChI Key :N/A
M.W :209.72 g/mol Pubchem ID :22379054
Synonyms :

Safety of [ 251107-31-0 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P261-P305+P351+P338 UN#:N/A
Hazard Statements:H302-H315-H319-H335 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 251107-31-0 ]

  • Downstream synthetic route of [ 251107-31-0 ]

[ 251107-31-0 ] Synthesis Path-Downstream   1~5

  • 1
  • [ 251107-31-0 ]
  • N-2'-toluoylacetamido-4-piperidone [ No CAS ]
  • 1-[4-(3-chloro-benzyl)-[1,4']bipiperidinyl-1'-yl]-2-<i>o</i>-tolyl-ethanone [ No CAS ]
  • 2
  • [ 552868-06-1 ]
  • [ 251107-31-0 ]
  • 4
  • [ 159635-49-1 ]
  • [ 251107-31-0 ]
  • 5
  • [ 33630-96-5 ]
  • [ 32315-10-9 ]
  • [ 251107-31-0 ]
  • 4-(3-chlorobenzyl)-N-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)piperidine-1-carboxamide [ No CAS ]
YieldReaction ConditionsOperation in experiment
33% To a solution of triphosgene (119 mg, 0.4 mmol) in dichloromethane (10 mL) -60 C was added a solution of 6-amino-2-methylpyridazin-3(2H)-one (100 mg, 0.8 mmol) and pyridine (253 mg, 3.2 mmol) in dichloromethane (5 mL) at under argon. The mixture was stirred at -60 C for 30 min and a solution of 4- (3-chlorobenzyl)piperidine (200 mg, 0.96 mmol) and pyridine (253 mg, 3.2 mmol) in dichloromethane (5 mL) was added at -60 C. The resulting mixture was stirred at 25 C for 16 h. The reaction was quenched with water (30 mL) and the aqueous layer was extracted with dichloromethane (50 mL x 2). The combined organic layers were dried over sodium sulfate, filtered and concentrated under reduced pressure. The crude sample was dissolved in the minimum amount of N,N-dimethylformamide and purified by prep-HPLC (Boston C18, 10 µm, 21 mm x 250 mm column, acetonitrile/10 mM ammonium acetate aqueous solution) to give 4-(3-chlorobenzyl)-N-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)piperidine- 1-carboxamide (93.7 mg, 0.26 mmol, 33%) as a brown solid.1H NMR (500 MHz, Dimethylsulfoxide-d6) 8.14 (s, 1H), 7.75-7.75 (m, 1H), 7.40 (dd, J1 = 2.5 Hz,J2 = 9.0 Hz, 1H), 7.32 (t, J = 8.0 Hz, 1H), 7.25-7.27 (m, 2H), 7.16 (d, J = 8.0 Hz,1H), 6.33 (d, J = 9.5 Hz, 1H), 4.27 (d, J = 13.5 Hz, 2H), 3.40 (s, 3H), 3.70 (t, J = 12.0 Hz, 2H), 2.50-2.55 (m, 1H), 1.70-1.75 (m,1H), 1.54-1.56 (m, 2H), 1.04-1.12 (m, 2H); LCMS (ESI) m/z: 360.1 [M+H]+.
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