Hexane → 3-1H-indol-4-yl-1-{[4-(trifluoromethyl)phenyl]methyl}urea

HRID 585948

Reaktionsgleichung

Reaktionsgleichung von HRID 585948
[N:1]([C:4]1[CH:12]=[CH:11][CH:10]=[C:9]2[C:5]=1[CH:6]=[CH:7][NH:8]2)=[C:2]=[O:3].[F:13][C:14]([F:24])([F:23])[C:15]1[CH:22]=[CH:21][C:18]([CH2:19][NH2:20])=[CH:17][CH:16]=1.CCCCCC>C1COCC1>[NH:8]1[C:9]2[C:5](=[C:4]([NH:1][C:2]([NH:20][CH2:19][C:18]3[CH:17]=[CH:16][C:15]([C:14]([F:13])([F:23])[F:24])=[CH:22][CH:21]=3)=[O:3])[CH:12]=[CH:11][CH:10]=2)[CH:6]=[CH:7]1

Komponenten

5

Edukt 3

HCID 8058HexaneHCID 768044-(Trifluoromethyl)benzylamineHCID 220326444-isocyanato-1H-indole

Produkt 1

HCID 103147593-1H-indol-4-yl-1-{[4-(trifluoromethyl)phenyl]methyl}urea

Reagenzien, Katalysatoren, Lösungsmittel 1

HCID 8028TetrahydrofuranLösungsmittel

Versuchsvorschrift

The product of Example 80A (0.16 g, 1 mmol) in THF (3 mL) was treated with 4-(trifluoromethyl)benzylamine (0.19 g, 1.1 mmol) at ambient temperature. After stirring for 3 hours, hexane was added to the reaction mixture to precipitate the title compound as a solid. mp 178° C. 1H NMR (300 MHz, DMSO-d6) δ 4.43 (d, 2H), 6.53 (t, 1H), (6.98 (m, 3H), 7.26 (t, 1H), 7.57 (d, 2H), 7.62 (d, 1H), 7.71 (d, 2H), 8.37 (s, 1H), 11.04 (s, 1H); MS (DCI+) m/z 334 (M+H); Anal. Calcd. For C17H14N3F3O: C, 61.26; H, 4.23; N, 12.61. Found: C, 61.28, H, 3.83; N, 12.31.

Aufarbeitung

  1. customto precipitate the title compound as a solid

Quellen und Nachweise

ORD-Eintrag
ord-22ef285b60f145908b821e2559935ae5
Quelldatensatz
uspto-grants-2005_08
Patentnummer
US06933311B2

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