Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
4-Isopropoxy-3-(methoxymethyl)benzoic acid → tert-butyl N-(2-fluoro-5-{5-[4-isopropoxy-3-(methoxymethyl)phenyl]-1,2,4-oxadiazol-3-yl}benzyl)-N-methylglycinate
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|---|---|---|
| 반응물 | 4-Isopropoxy-3-(methoxymethyl)benzoic acid | HCID 59495785 | — |
| 반응물 | tert-butyl N-{5-[amino(hydroxyimino)methyl]-2-fluorobenzyl}-N-methylglycinate | HCID 72307469 | — |
| 생성물 | tert-butyl N-(2-fluoro-5-{5-[4-isopropoxy-3-(methoxymethyl)phenyl]-1,2,4-oxadiazol-3-yl}benzyl)-N-methylglycinate | HCID 67528917 | — |
반응 단계
The title compound was prepared following procedure described for example 141, step 1, but starting from Intermediate 56 (134.55 mg; 0.60 mmol) and Intermediate 60 (177.47 mg; 0.57 mmol), the crude mixture was purified by flash chromatography (c-hex/(DCM/EtOAc 1:1) gradient from 1:0 to 1:1) to afford the title compound as a colorless oil. 1H NMR (CDCl3) δ 8.24-8.20 (m, 2H), 8.11-8.04 (m, 2H), 7.17 (t, J=9.0 Hz, 1H), 6.98 (d, J=8.8 Hz, 1H), 4.70 (quint., J=6.1 Hz, 1H), 4.54 (s, 2H), 3.89 (s, 2H), 3.50 (s, 3H), 3.27 (s, 2H), 2.46 (s, 3H), 1.51 (s, 9H), 1.40 (d, J=6.0 Hz, 6H). LC/MS (Method B): 500.4 (M+H)+. HPLC (Method A) Rt 4.44 min (Purity: 97.6%).
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 특허 번호 | US08202865B2 |
| 출처 데이터셋 | uspto-grants-2012_06 |
| ORD ID | ord-38bd7031c1d3431d8211670f0a2ab203 |
| 출처 메모 | uspto-grants-2012_06 |