HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 452327Generated: October 30, 2026
HCID 59214162, compound → HCID 86645556, compound
https://huagongshe.com/reaction/452327
Participants
| Role | Name | HCID | Charge |
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| Reactant | HCID 59214162 | HCID 59214162 | — |
| Reactant | HCID 86645557 | HCID 86645557 | — |
| Product | HCID 86645556 | HCID 86645556 | 19.21% |
Reaction Steps
T541 was prepared using general procedure B from 2-bromo-1-(2-(2-(2-fluoroethoxy)ethoxy)ethyl)-1H-benzo[d]imidazole and tert-butyl methyl-4-(ethynyl)phenylcarbamate. Reaction was performed on a 72 mgs scale of 2-bromo-1-(2-(2-(2-fluoroethoxy)ethoxy)ethyl)-1H-benzo[d]imidazole. The crude product was purified by ISCO column to afford tert-butyl 4-((1-(2-(2-(2-fluoroethoxy)ethoxy)ethyl)-1H-benzo[d]imidazol-2-yl)ethynyl)phenyl(methyl)carbamate (0.02 g, 19.21%). It was then dissolved in acetonitrile (1.0 mL). To this solution was added 20% Sulfuric acid (1.0 mL, 3.75 mmol). The reaction mixture was stirred at room temperature for 30 mins. The crude product was purified by prep HPLC to afford T541 TFA salt (0.004 g, 19.44%). 1H NMR (400 MHz, CD3CN) δ 7.78-7.76 (m, 1H), 7.70-7.68 (m, 1H), 7.51-7.45 (m, 4H), 6.66-6.64 (m, 2H), 4.63-4.60 (m, 2H), 4.44-4.42 (m, 1H), 4.32-4.30 (m, 1H), 3.95-3.92 (m, 2H), 3.57-3.53 (m, 3H), 3.48-3.45 (m, 3H), 2.82 (m, 3H). MS (ESI): 382.1 (M+H+).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08491869B2 |
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| Source dataset | uspto-grants-2013_07 |
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| ORD ID | ord-4235f0c282c44f048af7ca78dc200fc2 |
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| Source note | uspto-grants-2013_07 |
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