HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1962260Generated: October 31, 2026
Potassium Carbonate → HCID 136056017, compound
https://huagongshe.com/reaction/1962260
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Potassium Carbonate | HCID 11430 | — |
| Reactant | HCID 25185595 | HCID 25185595 | — |
| Reactant | 3H-1,2,4-Triazol-3-one, 5-(chloromethyl)-1,2-dihydro- | HCID 135546685 | — |
| Solvent | Methyl Ethyl Ketone | HCID 6569 | — |
| Product | HCID 136056017 | HCID 136056017 | 20.4% |
Reaction Steps
To a solution of 5-chloromethyl-2,4-dihydro-1,2,4-triazol-3-one (35 mg, 0.26 mmol) in 2-butanone, were added N2-(3-aminosulfonyl-4-fluorophenyl)-5-fluoro-N4-(4-hydroxyphenyl)-2,4-pyrimidinediamine (100 mg, 0.25 mmol) and potassium carbonate (35 mg, 0.25 mmol). The resulting mixture was microwaved at 140° C. for 5 hours, and then additional of 5-chloromethyl-2,4-dihydro-1,2,4-triazol-3-one was added as needed The reaction solvent was removed under a reduced pressure, and the residual was purified by column chromatography (silica gel, dichloromethane:methanol 8:2 v/v) to give 25 mg of N2-(3-aminosulfonyl-4-fluorophenyl)-5-fluoro-N4-[4-(2,4-dihydro-3-oxo-1,2,4-triazol-5-yl)methoxyphenyl]-2,4-pyrimidinediamine (76) as a light yellow solid. 1H NMR (D2O): δ 7.90-7.89 (d, J=3 Hz, 1H), 7.60-7.58 (d, J=6 Hz, 1H), 7.34 (bs, 2H), 7.24-7.18 (m, 2H), 7.05-7.02 (d, J=9.0 Hz, 2H), 6.65-6.62 (d, J=9.0 Hz, 2H), 5.11 (br s, 2H); LCMS (m/z): 491.05 (MH+).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|
| Patent number | US08415365B2 |
|---|
| Source dataset | uspto-grants-2013_04 |
|---|
| ORD ID | ord-e45244a53f2449d2aab6f290439c5821 |
|---|
| Source note | uspto-grants-2013_04 |
|---|