Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 44425생성일: 2026년 10월 25일
Dimethylformamide → 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)-N-(4-isopropylphenyl)-N-methylacetamide
https://huagongshe.com/reaction/44425
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | Dimethylformamide | HCID 6228 | — |
| 반응물 | Oxalyl chloride | HCID 65578 | — |
| 반응물 | Acefylline | HCID 69550 | — |
| 반응물 | Aniline, p-isopropyl-N-methyl- | HCID 138880 | — |
| 용매 | Chloroform | HCID 6212 | — |
| 용매 | Acetonitrile | HCID 6342 | — |
| 생성물 | 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)-N-(4-isopropylphenyl)-N-methylacetamide | HCID 59205108 | 84.4% |
반응 단계
To a solution of acid 101 (0.5 g, 2.1 mmol) in CHCl3 (30 mL) and CH3CN (30 mL) at 0° C. was added oxalyl chloride (1.59 g, 12.6 mmol) and a catalytic amount of DMF. The resulting solution was stirred for 2 h at rt and concentrated in vacuo. The resulting residue was re-dissolved in CHCl3 and cooled to 0° C. To this mixture was added N-methyl-4-isopropyl aniline (0.78 g, 5.2 mmol) and the reaction was stirred overnight warming to rt. The reaction mixture was diluted with CHCl3 (30 mL) and washed with 1 N HCl (50 mL). The combined organic layers were washed with water (75 mL), dried over Na2SO4 and concentrated in vacuo. The product was purified by chromatography on silica gel eluting with EtOAc/hexanes and EtOAc/MeOH to yield 393 as a light yellow solid (0.65 g, 84.4%). mp: 231-233° C. MS (APCI): m/z 370.2 [M+H]+. Anal. Calcd. For C19H23N5O3. 0.1 H2O: C, 61.47; H, 6.30; N, 18.87. Found C, 61.28; H, 6.19; N, 18.57.
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US08541423B2 |
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| 출처 데이터셋 | uspto-grants-2013_09 |
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| ORD ID | ord-520aa4812d404776bd4a5f1a0249eccd |
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| 출처 메모 | uspto-grants-2013_09 |
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