Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
1-Fluoro-4-(isocyanatomethyl)benzene → N-(8-bromoisoquinolin-5-yl)-N'-(4-fluorobenzyl)urea
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|---|---|---|
| 반응물 | 1-Fluoro-4-(isocyanatomethyl)benzene | HCID 2733376 | — |
| 반응물 | 8-Bromoisoquinolin-5-amine | HCID 22032630 | — |
| 생성물 | N-(8-bromoisoquinolin-5-yl)-N'-(4-fluorobenzyl)urea | HCID 10429462 | — |
반응 단계
The title compound was prepared using 1-fluoro-4-(isocyanatomethyl)benzene, the product of Example 73A and the procedure described in Example 73B (white solid, 108 mg, 65%). MS (ESI+) m/z 376 (M+H)+; MS (ESI−) m/z 374 (M−H)−; 1H NMR (DMSO-d6, 300 MHz) δ 4.35 (d, 5.8, 2H), 7.12 (m, 1H), 7.18 (m, 2H), 7.40 (m, 1H), 7.91 (d, J 8.5, 1H), 7.99 (d, J 6.1, 1H), 8.24 (d, J 8.5, 1H), 8.69 (d, J 5.8, 1H), 8.88 (s, 1H), 9.44 (s, 1H); Anal. Calcd for C17H13BrFN3O: C, 54.56; H, 3.50; N, 11.23. Found: C, 54.61; H, 3.35; N, 11.14.
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 특허 번호 | US08247413B2 |
| 출처 데이터셋 | uspto-grants-2012_08 |
| ORD ID | ord-749f69509c9645db8ffd40b12ca64b36 |
| 출처 메모 | uspto-grants-2012_08 |