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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1193180Generated: November 4, 2026

2-(Thiophen-2-yl)benzoic acid → HCID 52920166, compound

https://huagongshe.com/reaction/1193180

Reaction equation

Participants

RoleNameHCIDCharge
Reactant2-(Thiophen-2-yl)benzoic acidHCID 5105623—
Reactant5-fluoro-2-(2H-1,2,3-triazol-2-yl)benzoic acidHCID 67086948—
ReactantHCID 67116879HCID 67116879—
Reactant(1R,6S)-8-(4,6-Dimethyl-pyrimidin-2-yl)-3,8-diaza-bicyclo[4.2.0]octaneHCID 68156939—
SolventDichloromethaneHCID 6344—
ProductHCID 52920166HCID 52920166—

Reaction Steps

The title compound was prepared in a manner analogous to Example 1, substituting (1R,6S)-8-(3-methylpyrazin-2-yl)-3,8-diazabicyclo[4.2.0]octane (Intermediate 31) for (1R,6S)8-(4,6-dimethyl-pyrimidin-2-yl)-3,8-diaza-bicyclo[4.2.0]octane and 5-fluoro-2-[1,2,3]triazol-2-yl-benzoic acid (Intermediate 13) for 2-thiophen-2-yl-benzoic acid. DCM was used in place of DMF. MS (ESI) mass calcd. For C20H20FN7O, 393.43; m/z found 394.1 [M+H]+. 1H NMR (CD3OD): 8.10-8.01 (m, 1H), 7.97-7.88 (m, 2H), 7.83-7.74 (m, 1H), 7.67-7.61 (m, 1H), 7.47-7.22 (m, 2H), 4.52-4.30 (m, 2H), 4.22-3.83 (m, 2H), 3.75-3.11 (m, 3H), 2.72-2.31 (m, 4H), 2.18-1.50 (m, 2H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08680275B2
Source datasetuspto-grants-2014_03
ORD IDord-abf864d8bd254d0ab96d88b3ef1a129c
Source noteuspto-grants-2014_03