Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1911305Generated: October 26, 2026

Methyl 4-benzamidobenzoate → HCID 178490049, compound

https://huagongshe.com/reaction/1911305

Reaction equation

Participants

RoleNameHCIDCharge
ReactantMethyl 4-benzamidobenzoateHCID 727255—
ReactantTrimethylaluminumHCID 16682925—
Reactant1-tert-butyl-3-(3-methoxyphenethyl)-1H-pyrazol-5-amineHCID 57453934—
SolventFormic AcidHCID 284—
SolventTolueneHCID 1140—
SolventDichloromethaneHCID 6344—
ProductHCID 178490049HCID 178490049—

Reaction Conditions

Temperature82 °C

Reaction Steps

5-[2-(3-Methoxyphenyl)ethyl]-2-tert-butyl-pyrazol-3-amine (0.2 g, 0.73 mmol) was dissolved in toluene (10 ml) and to this was added methyl 4-benzamidobenzoate (200 mg, 0.80 mmol) and AlMe3 (0.93 ml, 1.8 mmol). The reaction was stirred overnight. The reaction was diluted with DCM (15 ml) and quenched with damp sodium sulfite. The reaction mixture was stirred for 20 mins before being filtered and the solvent removed in vacuo to yield a yellow gum. This gum was dissolved in formic acid (12 ml) and heated at 82° C. overnight. The reaction was evaporated to dryness and the resulting product was passed through a SCX column, eluting initially with methanol followed by 2N ammonia/methanol. After removal of the solvent, a yellow solid was obtained which was triturated with hot acetonitrile to afford a white solid. The solid was filtered and dried (66 mg, 21%); 1H NMR (400.132 MHz, DMSO) δ 2.91 (s, 4H), 3.74 (s, 3H), 6.46 (brs, 1H), 6.77 (d, 1H), 6.83 (s, 2H), 7.20 (t, 1H), 7.64-7.54 (m, 3H), 7.90 (d, 2H), 8.02-7.97 (m, 4H), 10.46 (s, 1H), 10.55 (s, 1H), 12.15 (s, 1H); MS: m/z 441 (MH+).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08604022B2
Source datasetuspto-grants-2013_12
ORD IDord-796e54dd7e7e445391c4d58529905760
Source noteuspto-grants-2013_12