HuagongsheHuagongshe Chemistry Print Report · For research reference only
61012-39-3 → HCID 67347860, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 61012-39-3 | HCID 3332472 | — |
| Reactant | 3-(5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl)benzoic acid | HCID 25180854 | — |
| Product | HCID 67347860 | HCID 67347860 | 21% |
Reaction Steps
This compound was synthesized from 2-(3-phenyl-1H-1,2,4-triazol-5-yl)ethanamine and 3-(5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl)benzoic acid as described in example 8 step 6 (17 mg, yield 21%). 1H NMR (400 MHz, CDCl3) δ 8.53 (s, 1H), 8.21-8.19 (d, J=7.8 Hz, 1H), 8.06-8.04 (t, J=7.8 Hz, 1H), 8.01-7.99 (m, 2H), 7.89 (m, 1H), 7.58-7.54 (d, J=7.8 Hz, 1H), 7.40-7.39 (m, 3H), 4.00-3.95 (q, J=5.9 Hz, 2H), 3.24-3.21 (d, J=6.1 Hz, 2H). MS (ESI) m/z: Calculated for C20H15F3N6O2: 428.12. found: 429.2 (M+H)+.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08901156B2 |
| Source dataset | uspto-grants-2014_12 |
| ORD ID | ord-49c9a2ae54e64d528ce10717e8fe2b43 |
| Source note | uspto-grants-2014_12 |