3,5-Difluorophenylacetic acid → HCID 70976245, compound

HRID 535613Notes

Reaction equation

HRID 535613 reaction equation
[NH2:1][N:2]1[N:11]=[C:10]([S:12][C:13]2[CH:18]=[CH:17][C:16]([Br:19])=[CH:15][CH:14]=2)[C:9]2[C:4](=[CH:5][CH:6]=[CH:7][CH:8]=2)[C:3]1=[O:20].[F:21][C:22]1[CH:23]=[C:24]([CH2:29][C:30](O)=[O:31])[CH:25]=[C:26]([F:28])[CH:27]=1>>[Br:19][C:16]1[CH:17]=[CH:18][C:13]([S:12][C:10]2[C:9]3[C:4](=[CH:5][CH:6]=[CH:7][CH:8]=3)[C:3](=[O:20])[N:2]([NH:1][C:30](=[O:31])[CH2:29][C:24]3[CH:23]=[C:22]([F:21])[CH:27]=[C:26]([F:28])[CH:25]=3)[N:11]=2)=[CH:14][CH:15]=1

Participants

3

Reactant 2

HCID 1454243,5-Difluorophenylacetic acidHCID 70975848HCID 70975848, compound

Product 1

HCID 70976245HCID 70976245, compound

Procedure

The product from Example 195B 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 11.76 (s, 1H), 8.39-8.32 (m, 1H), 8.08-8.04 (m, 1H), 8.02 (ddd, J=8.1, 7.6, 1.3, 1H), 7.95 (td, J=8.2, 1.3, 1H), 7.59-7.52 (m, 2H), 7.38 (ddd, J=6.6, 2.4, 1.4, 2H), 7.19-7.13 (m, 1H), 7.12-7.05 (m, 2H), 3.73 (s, 2H); MS (DCI+) M/Z 502 (M+H)+.

Sources & evidence

ORD record
ord-6d1b72c24d884ab78b39c1ec7d20726c
Source dataset
uspto-grants-2014_10
Patent number
US08859549B2

Reaction notes

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