HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1091427Generated: November 3, 2026
(2S)-2-amino butanic acid t-butyl ester → (s)-2-[3-(1-Tertbutoxycarbonyl-propylamino)-7-chloro-1-oxo-3,4-dihydro-1h-isoquinolin-2-yl]-butyric acid tert-butyl ester
https://huagongshe.com/reaction/1091427
Participants
| Role | Name | HCID | Charge |
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| Reactant | (2S)-2-amino butanic acid t-butyl ester | HCID 7019938 | — |
| Reactant | 7-chloro-1H-isochromen-1-one | HCID 11644028 | — |
| Product | (s)-2-[3-(1-Tertbutoxycarbonyl-propylamino)-7-chloro-1-oxo-3,4-dihydro-1h-isoquinolin-2-yl]-butyric acid tert-butyl ester | HCID 66593868 | 64.2% |
Reaction Steps
A mixture of 7-chloro-isochromen-1-one (10 g) and (S)-2-aminobutyric acid, tert butyl ester (22 g) were heated at 85° C. for 24 hours. The mixture was then cooled and purified by flash chromatography (5-25% ethyl acetate/hexane) to afford the sub-title compound as a yellow oil (17.1 g, 64%). 1H NMR (400 MHz, CDCl3) δ 0.68-1.32 (6H, m), 1.50 (21H, m), 1.92 (1H, m), 2.15 (1H, m), 2.82-3.40 (3H, m), 4.41 (1H, m), 4.68 (1H, m), 7.11 (1H, m), 7.35-7.52 (1H, m), 8.05 (1H, m) ppm.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08129381B2 |
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| Source dataset | uspto-grants-2012_03 |
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| ORD ID | ord-101d0f49cce24e2d9768a7e4ab24a865 |
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| Source note | uspto-grants-2012_03 |
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