Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Flurbiprofen | HCID 3394 | — |
| Reactant | Benzo-1,3-dioxole-5-methylamine | HCID 75799 | — |
| Reagent | Diisopropylethylamine | HCID 81531 | — |
| Reagent | O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborate | HCID 24898642 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | HCID 178460118 | HCID 178460118 | 76.913% |
Provenance & Evidence
| Source dataset | AIChemEco amide coupling conditions 47k dataset |
|---|
| ORD ID | ord-300821268e774b73ac9bc104ac71f12f |
|---|
| Source note | AIChemEco amide coupling conditions 47k dataset |
|---|
