Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 221760생성일: 2026년 10월 26일
((S)-5-{5-[(5-Cyano-pyridine-2-carbonyl)-amino]-2-fluoro-phenyl}-5-difluoromethyl-2,5,6,7-tetrahydro-[1,4]oxazepin-3-yl)-carbamic acid tert-butyl ester → Ethanol heptane
https://huagongshe.com/reaction/221760
참여 물질
| 역할 | 이름 | HCID | 투입량 |
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| 반응물 | ((S)-5-{5-[(5-Cyano-pyridine-2-carbonyl)-amino]-2-fluoro-phenyl}-5-difluoromethyl-2,5,6,7-tetrahydro-[1,4]oxazepin-3-yl)-carbamic acid tert-butyl ester | HCID 66666436 | — |
| 용매 | Dichloromethane | HCID 6344 | — |
| 용매 | Trifluoroacetic acid | HCID 6422 | — |
| 생성물 | Ethanol heptane | HCID 22502148 | 244.9% |
반응 단계
((S)-5-{5-[(5-Cyano-pyridine-2-carbonyl)-amino]-2-fluoro-phenyl}-5-difluoromethyl-2,5,6,7-tetrahydro-[1,4]oxazepin-3-yl)-carbamic acid tert-butyl ester (67.7 mg, 0.134 mmol) was dissolved in 0.75 mL dichloromethane and 0.25 mL trifluoroacetic acid. The solution was stirred at for 45 minutes and then evaporated at room temperature. The residue was dissolved in EtOAc and extracted with saturated aqueous NaHCO3 solution. The layers were washed with brine and EtOAc. The combined organic layers were dried over Na2SO4 and evaporated. The crude product was dissolved in THF, 0.2 mL HCl solution 1 mol/L in diethyl ether was added and the mixture was evaporated. The residue was crystallized from ethanol and TBME to give 48 mg of the title compound as white crystals.
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US08207164B2 |
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| 출처 데이터셋 | uspto-grants-2012_06 |
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| ORD ID | ord-586a144163db44618412439093ae75c4 |
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| 출처 메모 | uspto-grants-2012_06 |
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