Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 84517생성일: 2026년 10월 24일
Pyridine → 8-bromo-N-(2-chloro-4-(dimethylcarbamoyl)phenyl)-4,5-dihydro-benzo[b]thieno[2,3-d]oxepine-2-carboxamide
https://huagongshe.com/ko/reaction/84517
참여 물질
| 역할 | 이름 | HCID | 투입량 |
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| 반응물 | Pyridine | HCID 1049 | — |
| 반응물 | 4-Amino-3-chloro-N,N-dimethylbenzamide | HCID 20287481 | — |
| 반응물 | 8-Bromo-4,5-dihydrobenzo[b]thieno[2,3-d]oxepine-2-carboxylic acid | HCID 57900163 | — |
| 용매 | Tetrahydrofuran | HCID 8028 | — |
| 용매 | Thionyl Chloride | HCID 24386 | — |
| 생성물 | 8-bromo-N-(2-chloro-4-(dimethylcarbamoyl)phenyl)-4,5-dihydro-benzo[b]thieno[2,3-d]oxepine-2-carboxamide | HCID 56834157 | 77% |
반응 단계
A solution of 8-bromo-4,5-dihydrobenzo[b]thieno[2,3-d]oxepine-2-carboxylic acid (25.00 g, 76.9 mmol) in SOCl2 (200 mL) was heated at 90-100° C. for 3 h. Concentration of the reaction mixture gave the crude acid chloride. A suspension of the acid chloride in THF (600 mL) was treated with a solution of 4-amino-3-chloro-N,N-dimethylbenzamide (18.23 g, 92.3 mmol) and pyridine (14 mL) in THF (200 mL) at 0° C. The mixture was allowed to reach room temperature and stirred overnight. After concentration, water (200 mL) was added into the mixture. The resulting precipitate was collected by filtration, washed with water and dried to give 8-bromo-N-(2-chloro-4-(dimethylcarbamoyl)phenyl)-4,5-dihydro-benzo[b]thieno[2,3-d]oxepine-2-carboxamide (29.88 g, yield: 77%). ESI-MS: 504.99. 1H NMR (DMSO-d6, 400 MHz): δ10.14 (s, 1H, NH), 7.86 (s, 1H, ArH), 7.67-7.57 (m, 3H, ArH), 7.40-7.25 (m, 3H, ArH), 4.32 (t, J=5.2 Hz, 2H, CH2), 3.21 (t, J=5.2 Hz, 2H, CH2), 2.95 (s, 3H, CH3), 2.92 (s, 3H, CH3).
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US08846762B2 |
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| 출처 데이터셋 | uspto-grants-2014_09 |
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| ORD ID | ord-542e27bb7f59462aa2b7606a94207e9f |
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| 출처 메모 | uspto-grants-2014_09 |
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