참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | 5-Amino-1-chloroisoquinoline | HCID 459771 | — |
| 반응물 | 4-Bromobenzyl isocyanate | HCID 4374617 | — |
| 용매 | Toluene | HCID 1140 | — |
| 생성물 | N-[(4-bromophenyl)methyl]-N'-(1-chloroisoquinolin-5-yl)urea | HCID 10000490 | 63.1% |
반응 단계
The product from Example 64A (520 mg, 2.91 mmol) in toluene (8 mL) was treated with 1-bromo-4-(isocyanatomethyl)benzene (0.41 mL, 2.93 mmol) with stirring and then the mixture was heated at 90° C. for 2 hours. The mixture was allowed to cool to room temperature, filtered, the filter cake washed with toluene, and air-dried to provide the title compound as an off-white solid (717 mg, 63%). 1H NMR (300 MHz, DMSO-d6) δ 8.89 (s, 1H), 8.34-8.37 (m, 2H), 8.00 (dd, J=6.1 Hz, 0.7 Hz, 1H), 7.92-7.95 (m, 1H), 7.73 (t, J=8.1, 1H), 7.53-7.56 (m, 2H), 7.30-7.33 (m, 2H), 7.12 (t, J=5.8 Hz, 1H), 4.35 (d, J=5.8 Hz, 2H); MS (ESI+) m/z 390/392 (M+H+, 35Cl/37Cl).
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US06933311B2 |
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| 출처 데이터셋 | uspto-grants-2005_08 |
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| ORD ID | ord-39892923f27e43369156ebeada1e59bd |
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| 출처 메모 | uspto-grants-2005_08 |
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