2-(Thiophen-2-yl)benzoic acid → HCID 67117112, compound

HRID 1193192Notes

Reaction equation

HRID 1193192 reaction equation
C[C:2]1[CH:7]=[C:6]([CH3:8])N=[C:4]([N:9]2[C@@H:16]3[CH:11]([CH2:12][CH2:13][NH:14][CH2:15]3)[CH2:10]2)[N:3]=1.[F:17][C:18]1[CH:19]=[CH:20][C:21]([N:27]2[N:31]=[CH:30][CH:29]=[N:28]2)=[C:22]([CH:26]=1)[C:23](O)=[O:24].S1C=CC=[C:33]1C1C=CC=CC=1C(O)=O>>[F:17][C:18]1[CH:19]=[CH:20][C:21]([N:27]2[N:31]=[CH:30][CH:29]=[N:28]2)=[C:22]([C:23]([N:14]2[CH2:13][CH2:12][C@@H:11]3[C@@H:16]([N:9]([C:4]4[CH:33]=[C:6]([CH3:8])[CH:7]=[CH:2][N:3]=4)[CH2:10]3)[CH2:15]2)=[O:24])[CH:26]=1

Participants

4

Reactant 3

HCID 51056232-(Thiophen-2-yl)benzoic acidHCID 670869485-fluoro-2-(2H-1,2,3-triazol-2-yl)benzoic acidHCID 68156916HCID 68156916, compound

Product 1

HCID 67117112HCID 67117112, compound

Procedure

The title compound was prepared in a manner analogous to Example 1 substituting Intermediate 41 for (1R,RS)8-(4,6-dimethyl-pyrimidin-2-yl)-3,8-diaza-bicyclo[4.2.0]octane and 5-fluoro-2-(2H-1,2,3-triazol-2-yl)benzoic acid for 2-thiophene-2-yl-benzoic acid. MS (ESI) mass calcd. for O21H21FN6O, 392.4; m/z found, 393.2 [M+H]+.

Sources & evidence

ORD record
ord-4a21b3adc0a34d738ebe686552473475
Source dataset
uspto-grants-2014_03
Patent number
US08680275B2

Reaction notes

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