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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1972003Generated: October 28, 2026

Hydrochloric Acid → HCID 67373322, compound

https://huagongshe.com/reaction/1972003

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHydrochloric AcidHCID 313—
ReactantAcetyl chlorideHCID 6367—
ReactantIsobutyraldehydeHCID 6561—
ReactantDiisopropylethylamineHCID 81531—
ReactantSodium triacetoxyborohydrideHCID 5049666—
ReactantHCID 67373992HCID 67373992—
CatalystAcetic AcidHCID 176—
Catalyst4-(Dimethylamino)pyridineHCID 14284—
SolventDiethyl EtherHCID 3283—
SolventDichloromethaneHCID 6344—
SolventWater ethylacetateHCID 22728543—
ProductHCID 67373322HCID 6737332233.6%

Reaction Steps

To a solution of 5-[3-butyl-6-(1-methyl-piperidin-4-yloxy)-pyridazin-4-yl]-2-cyclohexyloxy-phenylamine (Example 62, 0.2 mmol, 88 mg) in DCM (2.0 mL) was added isobutyraldehyde (0.3 mmol, 28 μL), and 1 drop of acetic acid. Then sodium triacetoxyborohydride (0.6 mmol, 127 mg) was added. The mixture was stirred at room temperature for 1 hour then condensed. The mixture was then diluted with water/EtOAc. The solvent was removed in vacuo and the residue was again dissolved in DCM (2.0 mL) at 0° C., added acetyl chloride (0.4 mmol, 29 μL), DIEA (0.6 mmol, 105 μL) and DMAP (5 mg). And the mixture was stirred at room temperature for 1 hour. It was then condensed in vacuo and the residue was purified by silica gel chromatography (DCM to DCM+10% 2N NH3 in MeOH) to give a colorless sticky solid, which was dissolved in DCM (1.0 mL), 2N HCl in ether (1.0 mL) was added, kept at room temperature for 10 min, condensed, triturated with hexanes to provide the title compound (41 mg). LCMS: m/z 537 [M+1]. 1H NMR (400 MHz, CD3OD): δ 7.40-7.43 (1H, m), 7.28-7.35 (2H, m), 7.07 (1H, s), 5.52 (1H, bs), 4.53-4.59 (1H, m), 3.65-3.71 (1H, m), 3.29-3.47 (7H, m), 2.92-2.97 (2H, m), 2.89 (3H, s), 2.18-2.37 (4H, m), 1.99-2.07 (2H, m), 1.84 (3H, s), 1.25-1.83 (9H, m), 1.18-1.26 (2H, m), 0.91-0.95 (6H, m), 0.80 (3H, t).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08431575B2
Source datasetuspto-grants-2013_04
ORD IDord-86191449f9a343da8bd35c6830a87b72
Source noteuspto-grants-2013_04