HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1790686Generated: October 25, 2026
4-(Chloromethyl)benzoyl chloride → [4-(Chloromethyl)phenyl]-n-[5-(4-(3-pyridyl)pyrimidin-2-yloxy)benzimidazol-2-yl]carboxamide
https://huagongshe.com/reaction/1790686
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 4-(Chloromethyl)benzoyl chloride | HCID 70136 | — |
| Reactant | Sodium thiocyanate | HCID 516871 | — |
| Reactant | 1,3-Propanediamine, N'-(ethylcarbonimidoyl)-N,N-dimethyl-, monohydrochloride | HCID 2723939 | — |
| Reactant | 4-(4-(3-Pyridyl)pyrimidin-2-yloxy)benzene-1,2-diamine | HCID 22041328 | — |
| Solvent | Acetone | HCID 180 | — |
| Product | [4-(Chloromethyl)phenyl]-n-[5-(4-(3-pyridyl)pyrimidin-2-yloxy)benzimidazol-2-yl]carboxamide | HCID 131725841 | — |
Reaction Steps
A solution of sodium thiocyanate (1 eq) in acetone was added slowly in to a solution of 4-(chloromethyl)benzoylchloride (1 eq) in acetone at 0° C. The mixture was then filtered in to a solution of 4-(4-(3-pyridyl)pyrimidin-2-yloxy)benzene-1,2-diamine (1 eq) in acetone. Formation of N-acylthiourea was followed by LC/MS. The mixture was concentrated and taken in tetrahydrofuran and to it was added 1-ethyl-(3-dimethylaminopropyl)carbodimidehydrochloride (2 eq) and stirred at ambient temperature for 16 h. The mixture was concentrated and partitioned between ethyl acetate and water. The organic layer was then dried and concentrated to yield [4-(chloromethyl)phenyl]-N-[5-(4-(3-pyridyl)pyrimidin-2-yloxy)benzimidazol-2-yl]carboxamide. It was taken in tetrahydrofuran and added methylpiperazine (4 eq) and stirred at ambient temperature for 16 h. The reaction mixture was concentrated and purified on preparative chromatography to yield {4-[(4-methylpiperazinyl)methyl]phenyl}-N-[5-(4-(3-pyridyl)pyrimidin-2-yloxy)benzimidazol-2-yl]carboxamide. MS: MH+=520.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07071216B2 |
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| Source dataset | uspto-grants-2006_07 |
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| ORD ID | ord-084fb7b4da67426aa581b30a57eee387 |
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| Source note | uspto-grants-2006_07 |
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