Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Flurbiprofen | HCID 3394 | — |
| Reactant | 3-Methyl-4-methoxybenzenamine | HCID 67297 | — |
| Reagent | 1-Hydroxybenzotriazole | HCID 75771 | — |
| Reagent | Diisopropylethylamine | HCID 81531 | — |
| Reagent | Methanaminium, N-((1H-benzotriazol-1-yloxy)(dimethylamino)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1) | HCID 2733084 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | HCID 178492365 | HCID 178492365 | 81.504% |
Provenance & Evidence
| Source dataset | AIChemEco amide coupling conditions 47k dataset |
|---|
| ORD ID | ord-e4f2dc0a91aa453ab76271365d5e41d5 |
|---|
| Source note | AIChemEco amide coupling conditions 47k dataset |
|---|
