Hydrochloric Acid → HCID 53260305、化合物

HRID 2370341ノート

反応式

HRID 2370341 の反応式
C(OC(=O)[NH:7][C@H:8]([C:12](=[O:49])[NH:13][CH2:14][C:15]1[CH:20]=[CH:19][C:18]([F:21])=[C:17]([CH:22]2[CH2:27][CH2:26][N:25]([C:28]([C:30]3[C:38]4[C:33](=[C:34]([F:44])[CH:35]=[CH:36][C:37]=4[O:39][C:40]([F:43])([F:42])[F:41])[N:32]([CH2:45][CH2:46][O:47][CH3:48])[CH:31]=3)=[O:29])[CH2:24][CH2:23]2)[CH:16]=1)[CH:9]([CH3:11])[CH3:10])(C)(C)C.[ClH:51]>CCOCC>[ClH:51].[NH2:7][C@@H:8]([CH:9]([CH3:11])[CH3:10])[C:12]([NH:13][CH2:14][C:15]1[CH:20]=[CH:19][C:18]([F:21])=[C:17]([CH:22]2[CH2:27][CH2:26][N:25]([C:28]([C:30]3[C:38]4[C:33](=[C:34]([F:44])[CH:35]=[CH:36][C:37]=4[O:39][C:40]([F:41])([F:42])[F:43])[N:32]([CH2:45][CH2:46][O:47][CH3:48])[CH:31]=3)=[O:29])[CH2:24][CH2:23]2)[CH:16]=1)=[O:49]

参加物

4

反応物 2

HCID 313Hydrochloric AcidHCID 68228638HCID 68228638、化合物

生成物 1

HCID 53260305HCID 53260305、化合物収率 82%

試薬・触媒・溶媒 1

HCID 3283Diethyl Ether溶媒2 回

実験手順

To a solution of [(S)-1-(4-fluoro-3-{1-[7-fluoro-1-(2-methoxy-ethyl)-4-trifluoromethoxy-1H-indole-3-carbonyl]-piperidin-4-yl}-benzylcarbamoyl)-2-methyl-propyl]-carbamic acid tert-butyl ester (0.35 g, 0.49 mmol) in ether (20 mL) was added 2M HCl in ether (10 mL, 20.0 mmol). The reaction mixture was stirred at rt overnight. The resulting precipitate was collected to give the titled compound (260 mg, 82%). 1H NMR (300 MHz, DMSO-d6) δ 9.0 (m, 1H), 8.3 (bs, 2H), 7.7 (s, 1H), 7.3-7.0 (m, 5H), 4.5 (m, 2H), 4.4-4.2 (m, 2H), 3.7-3.5 (m, 6H), 3.2 (s, 3H), 3.1-2.9 (m, 2H), 2.1 (m, 1H), 1.85-1.5 (m, 4H), 0.9 (m, 6H). MS m/z: [M+H]+=611.

後処理

  1. customThe resulting precipitate was collected

出典と根拠

ORDレコード
ord-1787fa5e990647f2ac475e81de4b04eb
出典データセット
uspto-grants-2014_04
特許番号
US08710080B2

反応ノート

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