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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 1792875생성일: 2026년 10월 26일

Benzoic acid, 3-(chlorosulfonyl)- → 3-[(5S,9R)-9-(4-Cyanophenyl)-3-(3,5-dichlorophenyl)-1-methyl-2,4-dioxo-1,3,7-triazaspiro[4,4]nonane-7-sulfonyl]-benzoic acid

https://huagongshe.com/reaction/1792875

반응식

참여 물질

역할이름HCID투입량
반응물Benzoic acid, 3-(chlorosulfonyl)-HCID 77641—
반응물Sodium BicarbonateHCID 516892—
반응물4-[(5S,9R)-3-(3,5-Dichlorophenyl)-1-methyl-2,4-dioxo-1,3,7-triazaspiro[4.4]non-9-yl]-benzonitrileHCID 11994754—
용매AcetoneHCID 180—
용매WaterHCID 962—
생성물3-[(5S,9R)-9-(4-Cyanophenyl)-3-(3,5-dichlorophenyl)-1-methyl-2,4-dioxo-1,3,7-triazaspiro[4,4]nonane-7-sulfonyl]-benzoic acidHCID 2354040877%

반응 단계

To a mixture of 4-[(5S,9R)-3-(3,5-Dichlorophenyl)-1-methyl-2,4-dioxo-1,3,7-triazaspiro[4.4]non-9-yl]-benzonitrile (Example 15a) (0.11 g, 0.26 mmol) and (3-(Chlorosulfonyl)benzoic acid (0.058 g, 0.26 mmol) in acetone and water (1:1 mL) was added sodium bicarbonate at room temperature. The reaction mixture was stirred at room temperature for forty minutes, quenched by the slow addition of 1N hydrochloric acid (1 mL) and partitioned between DCM (2×20 mL) and brine (25 mL). The DCM layer was dried over sodium sulfate, concentrated and column purified using silica gel chromatography using DCM and MeOH to yield the titled compound (0.12 g). Retention time: 3.39 min. YMC S5 Combiscreen ODS 4.6×50 mm (4 minute gradient). Solvent A=10% MeOH, 90% water and 0.2% phosphoric acid. Solvent B=90% MeOH, 10% water and 0.2% phosphoric acid.

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US07078420B2
출처 데이터셋uspto-grants-2006_07
ORD IDord-fa608298f4e84e2c916e95bf0375dc9c
출처 메모uspto-grants-2006_07