3-(5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl)benzoic acid → HCID 67379137, compound

HRID 1397449Notes

Reaction equation

HRID 1397449 reaction equation
[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[O:9][CH:10]=[C:11]([CH2:13][CH2:14][NH2:15])[N:12]=2)=[CH:4][CH:3]=1.[F:16][C:17]([F:33])([F:32])[C:18]1[O:22][N:21]=[C:20]([C:23]2[CH:24]=[C:25]([CH:29]=[CH:30][CH:31]=2)[C:26](O)=[O:27])[N:19]=1>>[Cl:1][C:2]1[CH:3]=[CH:4][C:5]([C:8]2[O:9][CH:10]=[C:11]([CH2:13][CH2:14][NH:15][C:26](=[O:27])[C:25]3[CH:29]=[CH:30][CH:31]=[C:23]([C:20]4[N:19]=[C:18]([C:17]([F:33])([F:32])[F:16])[O:22][N:21]=4)[CH:24]=3)[N:12]=2)=[CH:6][CH:7]=1

Participants

3

Reactant 2

HCID 251808543-(5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl)benzoic acidHCID 67324267HCID 67324267, compound

Product 1

HCID 67379137HCID 67379137, compoundYield 2%

Procedure

This compound was synthesized from 2-(2-(4-chlorophenyl)oxazol-4-yl)ethanamine and 3-(5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl)benzoic acid as described in example 8 step 6 (4 mgs, 2% yield). 1H NMR (CDCl3) δ 8.55 (s, 1H), 8.25 (d, J=7.8 Hz, 1H), 8.12 (d, J=7.8 Hz, 1H), 7.98 (d, J=7.8 Hz, 2H), 7.68-7.54 (m, 2H), 7.41 (d, J=8.4 Hz, 2H), 3.86 (m, 2H), 3.94 (m, 2H). MS (ESI) m/z: Calculated for C21H14ClF3N4O3: 462.07. found: 463.1 (M+H)+.

Sources & evidence

ORD record
ord-50823b9c5dec4779badb1bd64e29f710
Source dataset
uspto-grants-2014_12
Patent number
US08901156B2

Reaction notes

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