HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1621600Generated: October 27, 2026
Benzeneethanamine, alpha-methyl-, phosphate (1:1) → 4-(5-chloro-2-fluoropyridin-3-yl)-N,N-bis(4-methoxybenzyl)-6-methyl-1,3,5-triazin-2-amine
https://huagongshe.com/reaction/1621600
Participants
| Role | Name | HCID | Charge |
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| Reactant | Benzeneethanamine, alpha-methyl-, phosphate (1:1) | HCID 62885 | — |
| Reactant | Potassium Acetate | HCID 517044 | — |
| Reactant | 5-Chloro-2-fluoropyridine-3-boronic Acid | HCID 24901779 | — |
| Reactant | 4-chloro-N,N-bis(4-methoxybenzyl)-6-methyl-1,3,5-triazin-2-amine | HCID 59548209 | — |
| Catalyst | di-tert-butyl(4-dimethylaminophenylphosphine) dichloropalladium(II) | HCID 86647055 | — |
| Solvent | Ethanol | HCID 702 | — |
| Solvent | Water | HCID 962 | — |
| Product | 4-(5-chloro-2-fluoropyridin-3-yl)-N,N-bis(4-methoxybenzyl)-6-methyl-1,3,5-triazin-2-amine | HCID 66600504 | 55.4% |
Reaction Steps
A mixture of 5-chloro-2-fluoropyridin-3-ylboronic acid (Combi Block, Inc., 2.507 g, 14.30 mmol), 4-chloro-N,N-bis(4-methoxybenzyl)-6-methyl-1,3,5-triazin-2-amine (5.24 g, 13.62 mmol), Amphos (bis-4-(di-tert-butylphosphanyl)-N,N-dimethylaniline-dichloropalladium, 0.482 g, 0.681 mmol) and potassium acetate (4.10 g, 41.8 mmol) in ethanol (100 mL) and water (10 mL) was purged with argon and heated at 100° C. overnight. The reaction mixture was cooled, concentrated to remove the EtOH and partitioned between water (50 mL) and EtOAc (50 mL). The aqueous phase was extracted with EtOAc (2×20 mL). The combined organic phases were washed with saturated aqueous sodium chloride (100 mL). The organic phase was dried over sodium sulfate, filtered and concentrated. The crude product was purified by ISCO chromatography (hexanes/EtOAc, 15 to 50%) to give 4-(5-chloro-2-fluoropyridin-3-yl)-N,N-bis(4-methoxybenzyl)-6-methyl-1,3,5-triazin-2-amine (3.62 g, 7.54 mmol, 55.4% yield) as a colorless sticky solid. m/z (ESI, +ve ion) 481.0 (M+H)+.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08772480B2 |
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| Source dataset | uspto-grants-2014_07 |
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| ORD ID | ord-1314979b5fbb4ac3a19128ff1f2053f4 |
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| Source note | uspto-grants-2014_07 |
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