Benzenamine, 4-(4-morpholinyl)- → HCID 11639913, 화합물

HRID 729306노트

반응식

HRID 729306 반응식
Cl[C:2]1[C:3](=[O:16])[N:4]([CH3:15])[S:5](=[O:14])(=[O:13])[C:6]=1[C:7]1[CH:12]=[CH:11][CH:10]=[CH:9][CH:8]=1.[O:17]1[CH2:22][CH2:21][N:20]([C:23]2[CH:29]=[CH:28][C:26]([NH2:27])=[CH:25][CH:24]=2)[CH2:19][CH2:18]1>CC#N>[CH3:15][N:4]1[C:3](=[O:16])[C:2]([NH:27][C:26]2[CH:25]=[CH:24][C:23]([N:20]3[CH2:21][CH2:22][O:17][CH2:18][CH2:19]3)=[CH:29][CH:28]=2)=[C:6]([C:7]2[CH:12]=[CH:11][CH:10]=[CH:9][CH:8]=2)[S:5]1(=[O:14])=[O:13]

참가 물질

4

반응물 2

HCID 75655Benzenamine, 4-(4-morpholinyl)-HCID 686620174-Chloro-2-methyl-5-phenylisothiazol-3(2H)-one 1,1-dioxide

생성물 1

HCID 11639913HCID 11639913, 화합물수율 42.6%

시약·촉매·용매 1

HCID 6342Acetonitrile용매

실험 절차

4-Chloro-2-methyl-5-phenylisothiazol-3(2H)-one 1,1-dioxide (70 mg, 0.27 mmol) and 4-morpholinoaniline (97 mg, 0.54 mmol) in MeCN (2 ml) was heated in a microwave reactor at 140° C. for 15 mins, then at 140° C. for 15 mins. The mixture was purified by preparative HPLC (Kromasil-column C8, 0.1M NH4OAc/MeCN, gradient) to give the title compound (46 mg, 42%); 1H NMR (400 MHz, CDCl3): δ 7.10-7.23 (m, 6H), 6.58-6.63 (m, 2H), 6.49-6.55 (m, 2H), 3.77-3.83 (m, 4H), 3.27 (s, 3H), 2.96-3.01 (m, 4H); Mass Spectrum: M+H+ 400.

후처리

  1. customThe mixture was purified by preparative HPLC (Kromasil-column C8, 0.1M NH4OAc/MeCN, gradient)

출처 및 근거

ORD 기록
ord-c6a4ece3b2474ef0923fd89743e3eb5f
출처 데이터셋
uspto-grants-2009_09
특허 번호
US07582629B2

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