HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-(5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl)benzoic acid → HCID 69935727, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 3-(5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl)benzoic acid | HCID 25180854 | — |
| Reactant | HCID 131732580 | HCID 131732580 | — |
| Product | HCID 69935727 | HCID 69935727 | 27% |
Reaction Steps
This compound was synthesized from (1S,4S)-2-(pyridin-2-yl)-2,5-diazabicyclo[2.2.1]heptane TFA salt and 3-(5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl)benzoic acid as described for example 37 step 3 (30 mg, yield 27%). 1H NMR (400 MHz, CDCl3) δ8.28-8.07 (m, 3H), 7.74-7.71 (m, 1H), 7.65-7.43 (m, 2H), 6.66-6.55 (m, 1H), 6.45-6.33 (m, 1H), 5.16-4.94 (m, 2H), 3.82-3.49 (m, 4H), 2.10-2.05 (m, 2H). MS (ESI) m/z: Calculated for C20H16F3N5O2: 415.13. found: 416.2 (M+H)+
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08981084B2 |
| Source dataset | uspto-grants-2015_03 |
| ORD ID | ord-a1f448eee5d240828960f4ad2f38b93d |
| Source note | uspto-grants-2015_03 |