Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
2486-69-3 → 4-(9-Cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[5,4-b][1,4]diazepin-2-ylamino)-3-methoxybenzoic acid
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|---|---|---|
| 반응물 | 2486-69-3 | HCID 288057 | — |
| 반응물 | 2-Chloro-9-cyclopentyl-7,7-difluoro-5-methyl-8,9-dihydro-5H-pyrimido[4,5-B][1,4]diazepin-6(7H)-one | HCID 57955574 | — |
| 촉매 | Hydrochloric Acid | HCID 313 | — |
| 용매 | Isopropanol | HCID 3776 | — |
| 생성물 | 4-(9-Cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[5,4-b][1,4]diazepin-2-ylamino)-3-methoxybenzoic acid | HCID 25252905 | — |
반응 단계
2-Chloro-9-cyclopentyl-7,7-difluoro-5-methyl-8,9-dihydro-5H-pyrimido[5,4-b][1,4]diazepin-6(7H)-one (obtained above), 4-amino-3-methoxy benzoic acid (334 mg, 2 mmol), i-PrOH (10 mL) and conc. HCl (10 drops) were heated to 100° C. overnight. The reaction mixture was then cooled to room temperature, concentrated and redissolved in MeOH, treated with NaOH and refluxed for 1 hr. After which, it was concentrated, acidified with HCl and filtered to give the title as a tan solid (300 mg). [M+H] calc'd for C21H23F2N5O4, 448; found 448.
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 특허 번호 | US08202990B2 |
| 출처 데이터셋 | uspto-grants-2012_06 |
| ORD ID | ord-8936ff2a70b34497bcb94b245797cc00 |
| 출처 메모 | uspto-grants-2012_06 |