Hydrochloric Acid → HCID 53260305, Verbindung

HRID 2370341Notizen

Reaktionsgleichung

Reaktionsgleichung von HRID 2370341
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]

Komponenten

4

Edukt 2

HCID 313Hydrochloric AcidHCID 68228638HCID 68228638, Verbindung

Produkt 1

HCID 53260305HCID 53260305, VerbindungAusbeute 82 %

Reagenzien, Katalysatoren, Lösungsmittel 1

HCID 3283Diethyl EtherLösungsmittel2×

Versuchsvorschrift

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.

Aufarbeitung

  1. customThe resulting precipitate was collected

Quellen und Nachweise

ORD-Eintrag
ord-1787fa5e990647f2ac475e81de4b04eb
Quelldatensatz
uspto-grants-2014_04
Patentnummer
US08710080B2

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