Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
5-Isocyanatoisoquinoline → N-[4-(1-azepanyl)-3-fluorobenzyl]-N'-(3-methyl-5-isoquinolinyl)urea
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|---|---|---|
| 반응물 | 5-Isocyanatoisoquinoline | HCID 11586357 | — |
| 반응물 | 5-Isocyanato-3-methylisoquinoline | HCID 22228382 | — |
| 반응물 | 4-(1-Azepanyl)-3-fluorobenzylamine | HCID 22337567 | — |
| 생성물 | N-[4-(1-azepanyl)-3-fluorobenzyl]-N'-(3-methyl-5-isoquinolinyl)urea | HCID 10092755 | — |
반응 단계
The title compound was prepared using the procedure described in Example 61B using 4-(1-azepanyl)-3-fluorobenzylamine and the product from Example 154A instead of 4-cyanobenzyl alcohol and the product from Example 61A. 1H NMR (300 MHz, DMSO-d6) δ 9.74 (s, 1H), 8.50 (s, 1H), 8.67 (s, 1H), 8.60 (d, 1H, J=8.1 Hz), 8.14 (d, 1H, J=8.1 Hz), 7.83 (t, 1H, J=8.1 Hz), 7.56 (t, 1H), 7.04 (m, 2H), 6.90 (m, 1H), 4.26 (d, 2H, J=6 Hz), 3.32 (m, 4H), 2.79 (s, 3H), 1.75 (m, 4H), 1.55 (m, 4H); MS (ESI) 407 (M+H)+; Anal. Calcd for C24H27FN4O.2HCl: C, 60.13; H, 6.10; N, 11.69. Found: C, 60.09; H, 6.35; N, 11.47.
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 특허 번호 | US08247413B2 |
| 출처 데이터셋 | uspto-grants-2012_08 |
| ORD ID | ord-dec370d4f90a4511aa39fdc741d748b7 |
| 출처 메모 | uspto-grants-2012_08 |