関与物質
| 役割 | 名称 | HCID | 仕込み量 |
|---|
| 反応物 | 4-Bromobenzyl isocyanate | HCID 4374617 | — |
| 反応物 | 1,3-Dimethylisoquinolin-5-amine | HCID 22337624 | — |
| 溶媒 | Toluene | HCID 1140 | — |
| 生成物 | N-(4-bromobenzyl)-N'-(1,3-dimethyl-5-isoquinolinyl)urea | HCID 11740716 | — |
反応手順
The product from Example 178A(375 mg, 2.2 mmol) in toluene (7 mL) was treated with 1-bromo-4-(isocyanatomethyl)benzene (0.31 mL, 2.2 mmol). After stirring at 85-90° C. for 3 hours, the mixture was cooled to room temperature and filtered. The filter cake was treated with methanolic HCl to provide the title compound as the hydrochloride salt. 1H NMR (300 MHz, DMSO-d6) δ 8.62 (s, 1H), 8.17 (d, 1H, J=7.8 Hz), 7.80 (d, 1H, J=8.5 Hz), 7.45-7.60 (m, 4H), 7.32 (d, 2H, J=8.1 Hz), 7.06 (t, 1H, 5.7 Hz), 4.34 (d, 2H, 5.8 Hz), 2.84 (s, 3H), 2.75 (s, 3H); MS (ESI+) m/z 383/385 (M+H, 79Br/81Br).
情報源と証拠
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 特許番号 | US07335678B2 |
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| 出典データセット | uspto-grants-2008_02 |
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| ORD ID | ord-a74fa34e5dc84ab780a9201881262148 |
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| 出典メモ | uspto-grants-2008_02 |
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