HuagongsheHuagongshe Chemistry Print Report · For research reference only
Trifluoroacetic acid → HCID 86602084, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Trifluoroacetic acid | HCID 6422 | — |
| Reactant | HCID 58746505 | HCID 58746505 | — |
| Product | HCID 86602084 | HCID 86602084 | 34% |
Reaction Steps
A solution of ethyl [((1S)-1-(1h-benzimidazol-2-yl)-2-[4-(2-tert-butyl-1,1-dioxido-3-oxoisothiazolidin-5-yl)phenyl]ethylamino)carbonyl]aminoacetate (4 mg, 7.20 μmol) and trifluoroacetic acid (1.50 mL) was heated at 120° C. for 5 min in the microwave. The reaction concentrated in vacuo and purified by preparative LCMS to yield the desired product (1.5 mg, 34%). 1H NMR (400 MHz, CD3OD): δ 7.7 (m, 2H), 7.6 (m, 2H), 7.5 (m, 2H), 7.3 (m, 2H), 5.3 (m, 1H), 5.2 (m, 1H), 4.2 (m, 2H), 3.8 (m, 2H), 3.5–3.3 (m, 4H), 1.2 (t, 3H); MF=C25H26F3N5O8S; LCMS found for C23H26N5O6S (M+H)+: m/z=500.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US07141596B2 |
| Source dataset | uspto-grants-2006_11 |
| ORD ID | ord-cb9d3536700245aca65cf997a1a81f7a |
| Source note | uspto-grants-2006_11 |