HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 879466Erstellt: 24. Oktober 2026
5-Methylindoline → (S)-2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(5-methylindolin-1-yl)benzo[d]thiazol-6-yl)acetic acid
https://huagongshe.com/de/reaction/879466
Beteiligte Stoffe
| Rolle | Name | HCID | Einwaage |
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| Edukt | 5-Methylindoline | HCID 14023679 | — |
| Edukt | 1,2-Dihydro-3H-pyrrolo(3,4-c)pyridin-3-one | HCID 20505166 | — |
| Edukt | (S)-ethyl 2-(2-bromo-7-(4-chlorophenyl)-5-methylbenzo[d]thiazol-6-yl)-2-tert-butoxyacetate | HCID 86700141 | — |
| Edukt | (S)-2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(2-(3-oxo-1H-pyrrolo[3,4-c]pyridin-2(3H)-yl)pyridin-4-yl)benzo[d]thiazol-6-yl)acetic acid | HCID 86700276 | — |
| Katalysator | HCID 178418851 | HCID 178418851 | — |
| Produkt | (S)-2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(5-methylindolin-1-yl)benzo[d]thiazol-6-yl)acetic acid | HCID 86700277 | — |
Reaktionsschritte
(S)-2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(5-methylindolin-1-yl)benzo[d]thiazol-6-yl)acetic acid was prepared in similar manner as (S)-2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(2-(3-oxo-1H-pyrrolo[3,4-c]pyridin-2(3H)-yl)pyridin-4-yl)benzo[d]thiazol-6-yl)acetic acid except (S)-ethyl 2-(2-bromo-7-(4-chlorophenyl)-5-methylbenzo[d]thiazol-6-yl)-2-tert-butoxyacetate was used instead of (S)-ethyl 2-tert-butoxy-2-(7-(4-chlorophenyl)-2-(2-chloropyridin-4-yl)-5-methylbenzo[d]thiazol-6-yl)acetate, 5-Methylindoline was used instead 1H-pyrrolo[3,4-c]pyridin-3(2H)-one and Pd(P-tBu3)2 was used instead of Pd2(dba)3. LCMS-ESI+: C29H30ClN2O3S: 521.2 (M+H+); Found: 521.2 (M+H+); 1H NMR (400 MHz, CD3OD) δ: 7.75 (s, 1H), 7.67-7.64 (m, 1H), 7.57-7.50 (m, 3H), 7.44 (s, 1H), 7.12 (d, 1H), 6.84 (d, 1H), 5.17 (s, 1H), 4.07 (dd, 2H), 3.19 (dd, 2H), 2.53 (s, 3H), 2.35 (s, 3H), 0.95 (s, 9H).
Herkunft & Nachweise
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patentnummer | US08987250B2 |
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| Quelldatensatz | uspto-grants-2015_03 |
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| ORD ID | ord-00be1056b0d14a0cb68a27ec482d8569 |
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| Quellennotiz | uspto-grants-2015_03 |
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