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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1009804Generated: October 30, 2026

Aniline → HCID 59595044, compound

https://huagongshe.com/reaction/1009804

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAnilineHCID 6115—
ReactantDiisopropylethylamineHCID 81531—
ReactantSodium BicarbonateHCID 516892—
ReactantMethanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)HCID 9886157—
ReactantHCID 25022526HCID 25022526—
Solvent1,2-DichloroethaneHCID 11—
SolventWaterHCID 962—
SolventN-methyl-2-pyrrolidoneHCID 13387—
SolventEthyl ether methylene chlorideHCID 21881112—
ProductHCID 59595044HCID 5959504469%

Reaction Steps

To a solution of 3-amino-5-(4-chlorophenyl)thiophene-2-carboxylic acid prepared in Example 1, Part A (104 mg, 0.41 mmol) in NMP (1.8 mL) were added O-(7-azabenzotriazol-1-yl)-N,N,N′,N′-tetramethyluronium hexafluorophosphate (HATU) (195 mg, 0.51 mmol) and N,N-diisopropylethylamine (0.22 mL, 1.26 mmol). After the resulting solution was stirred at RT for 2.3 h, a solution of the aniline prepared in Part B of Example 2 (84.3 mg, 0.465 mmol) in 1,2-dichloroethane (0.8 mL+0.4 mL rinse) was added. After heating at 80° C. with stirring for 16 h, the reaction was cooled to RT before being diluted first with water (30 mL) and then sat'd NaHCO3 (5.5 mL). Following extraction of the aqueous mixture (pH ˜9) with EtOAc (3×30 mL), the combined organic extracts were washed with water (20 mL), dried (Na2SO4) and evaporated. Chromatography (SiO2 230-400 mesh, 9/1 CH2Cl2/Ether) of the crude provided the desired amide (118.2 mg, 69% yield) as a yellow solid: MS (electrospray, + ions) m/z 417 (M+H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07973159B2
Source datasetuspto-grants-2011_07
ORD IDord-55f258a3e5c9459dbfcad458b6c9b5ed
Source noteuspto-grants-2011_07