HuagongsheHuagongshe Chemistry Print Report · For research reference only
Isonicotinic Acid → HCID 44468933, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Isonicotinic Acid | HCID 5922 | — |
| Reactant | HCID 49780164 | HCID 49780164 | — |
| Product | HCID 44468933 | HCID 44468933 | — |
Reaction Steps
Intermediate 42 (152 mg, 0.5 mmol) was reacted with isonicotinic acid by Method E. Flash chromatography eluted with 9:1 DCM:MeOH afforded compound 47 (204 mg, 100%) as a white solid: Mp 210-212° C. 1H NMR (500 MHz, DMSO-d6) δ 8.67 (d, J=6 Hz, 2H), 8.59 (s, 1H), 7.47 (d, J=9 Hz, 2H), 7.38 (d, J=6 Hz, 2H), 7.22 (d, J=9 Hz, 2H), 6.25 (d, J=8 Hz, 1H), 4.30 (d, J=12 Hz, 1H), 3.76 (s, 1H), 3.41 (d, J=12 Hz, 1H), 3.16 (t, J=12 Hz, 1H), 3.05 (t, J=12 Hz, 1H), 1.97-1.88 (m, 1H), 1.84-1.75 (m, 1H), 1.47-1.29 (m, 2H). Purity 92%. HRMS calculated for C19H19F3N4O3−H+ 407.1331. found (ESI(−), [M−H]) 407.1316.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US09296693B2 |
| Source dataset | uspto-grants-2016_03 |
| ORD ID | ord-9b36006ed0254f9ea2c2d86126ef97a3 |
| Source note | uspto-grants-2016_03 |