HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1746909Generated: October 28, 2026
2-Iodobenzoic acid → HCID 71768544, compound
https://huagongshe.com/reaction/1746909
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 2-Iodobenzoic acid | HCID 6941 | — |
| Reactant | HCID 89852017 | HCID 89852017 | — |
| Solvent | Dimethyl Sulfoxide | HCID 679 | — |
| Product | HCID 71768544 | HCID 71768544 | 105.1% |
Reaction Steps
Oxidation of 2-(3-((2H-benzo[b][1,4]oxazin-4(3H)-yl)methyl)-1H-pyrazol-1-yl)-N-(4-amino-3-hydroxy-4-oxo-1-phenylbutan-2-yl)nicotinamide (210 mg, 0.410 mmol) in DMSO (6 mL) with 2-iodobenzoic acid as described for example 2.4 gave 220 mg of a yellow solid, which was purified by chromatography over silica gel (eluent CH2Cl2+0-15% methanol). After concentration the obtained solid was recrystallized from 2-propanol to give 78 mg of the title compound as an amorphous solid; ESI-MS [M+H]+: 511.2. 1H-NMR (400 MHz, DMSO), δ[ppm]: 8.97 (m, 1H), 8.55 (m, 1H), 8.29 (m, 1H), 8.09 (m, 1H), 7.84 (m, 1H), 7.70 (m, 1H), 7.44 (m, 1H), 7.31 (m, 4H), 7.22 (m, 1H), 6.82 (m, 1H), 6.70 (m, 1H), 6.61 (m, 1H), 6.50 (m, 1H), 6.34 (m, 1H), 5.44 (m, 1H), 4.26 (d, 1H), 4.20 (d, 1H), 4.12 (m, 2H), 3.25 (m, 3H), 2.88 (dd, 1H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|
| Patent number | US09150545B2 |
|---|
| Source dataset | uspto-grants-2015_10 |
|---|
| ORD ID | ord-1f8bb488d3e747a28f0c5ed00a45b748 |
|---|
| Source note | uspto-grants-2015_10 |
|---|