3,5-Difluorophenylacetic acid → HCID 70976073, compound

HRID 535507Notes

Reaction equation

HRID 535507 reaction equation
[NH2:1][N:2]1[N:11]=[C:10]([S:12][C:13]2[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=2)[C:9]2[C:4](=[CH:5][CH:6]=[CH:7][CH:8]=2)[C:3]1=[O:19].[F:20][C:21]1[CH:22]=[C:23]([CH2:28][C:29](O)=[O:30])[CH:24]=[C:25]([F:27])[CH:26]=1>>[F:20][C:21]1[CH:22]=[C:23]([CH2:28][C:29]([NH:1][N:2]2[N:11]=[C:10]([S:12][C:13]3[CH:14]=[CH:15][CH:16]=[CH:17][CH:18]=3)[C:9]3[C:4](=[CH:5][CH:6]=[CH:7][CH:8]=3)[C:3]2=[O:19])=[O:30])[CH:24]=[C:25]([F:27])[CH:26]=1

Participants

3

Reactant 2

HCID 1454243,5-Difluorophenylacetic acidHCID 70976345HCID 70976345, compound

Product 1

HCID 70976073HCID 70976073, compound

Procedure

The product from Example 57B and 2-(3,5-difluorophenyl)acetic acid were processed using a method similar to that described in Example 10C to afford the title compound: 1H NMR (500 MHz, DMSO-d6) δ 11.74 (s, 1H), 8.35 (dd, J=7.9, 1.0, 1H), 8.09 (d, J=7.8, 1H), 8.04-7.98 (m, 1H), 7.94 (td, J=7.7, 1.1, 1H), 7.47-7.40 (m, 2H), 7.39-7.28 (m, 3H), 7.16 (tt, J=9.5, 2.3, 1H), 7.12-7.04 (m, 2H), 3.73 (s, 2H); MS (APCI+) M/Z 424 (M+H)+.

Sources & evidence

ORD record
ord-a5ed682589cf444793038b82a6b48a5d
Source dataset
uspto-grants-2014_10
Patent number
US08859549B2

Reaction notes

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