참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | 3-Bromopyridine | HCID 12286 | — |
| 반응물 | Ammonium Chloride | HCID 25517 | — |
| 반응물 | 2-Benzothiazol-2-yl-3,3-bis-methylsulfanylacrylonitrile | HCID 2807727 | — |
| 반응물 | Butyllithium | HCID 178418339 | — |
| 반응물 | HCID 178418470 | HCID 178418470 | — |
| 용매 | Diethyl Ether | HCID 3283 | — |
| 용매 | Tetrahydrofuran | HCID 8028 | — |
| 용매 | Cyclohexane | HCID 8078 | — |
| 생성물 | 4-Benzothiazol-2-YL-5-pyridin-3-YL-1H-pyrazol-3-ylamine | HCID 66768274 | 65% |
반응 단계
A yellow suspension of 3-pyridinyl lithium in THF was prepared according to the literature (Cama, L. D.; Wildonger, K. J.; Guthikonda, R.; Ratcliffe, R. W.; Christensen, B. G. Tetrahedron (1983), 39, 2531) by adding n-BuLi (0.25 mL of a 2 M solution in cyclohexane, 0.5 mmol) to a solution of 3-bromopyridine (87 mg, 0.5 mmol) in anhydrous ether (3 mL) at −78° C. To this slurry was rapidly added 2-benzothiazol-2-yl-3,3-bismethylsulfanylacrylonitrile (140 mg, 0.5 mmol) in anhydrous THF (5 mL) under argon. The resulting mixture was stirred at −78° C. for 1 hour, and then slowly warmed up to room temperature and stirred at that temperature for 2 hours. Upon completion of the reaction, the mixture was poured into a saturated NH4Cl aqueous solution. The aqueous phase was extracted with ethyl acetate. The organic phase was washed with brine, dried over magnesium sulfate, filtered and evaporated. The crude material was then purified by flash chromatography eluting with CH2Cl2:MeOH=1:0-19:1 to yield 100 mg (65%) of the desired product as a brown oil. MS (m/z, ES+): 310 (M+1, 25%), 263 (M−46, 100%).
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US08754233B2 |
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| 출처 데이터셋 | uspto-grants-2014_06 |
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| ORD ID | ord-2b04432a85644bff9db0ac1ffd348bdf |
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| 출처 메모 | uspto-grants-2014_06 |
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