HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1362328Generated: October 29, 2026
Tri-o-tolylphosphine → HCID 16659986, compound
https://huagongshe.com/reaction/1362328
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Tri-o-tolylphosphine | HCID 80271 | — |
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | N-Methyl-N-[(1-methyl-2-indolyl)methyl]acrylamide | HCID 20752825 | — |
| Reactant | 7-Bromo-3,3-dimethyl-1,3,4,5-tetrahydropyrido[2,3-e][1,4]diazepin-2-one | HCID 59456914 | — |
| Catalyst | palladium(II) acetate | HCID 167845 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Solvent | Propionitrile | HCID 7854 | — |
| Solvent | Ethyl Acetate | HCID 8857 | — |
| Product | HCID 16659986 | HCID 16659986 | 52.3% |
Reaction Steps
A suspension of 7-bromo-3,3-dimethyl-1,3,4,5-tetrahydro-pyrido[2,3-e][1,4]diazepin-2-one (0.30 g, 1.1 mmol) and N-methyl-N-(1-methyl-1H-indol-2-ylmethyl)acrylamide (0.35 g, 1.3 mmol) in propionitrile (5 mL) and DMF (1.3 mL) was de-oxygenated with Ar for 10 min. The mixture was treated with (i-Pr)2EtN (0.41 mL, 2.4 mmol) and was de-oxygenated with Ar for 5 min. Pd(OAc)2 (25 mg, 0.11 mmol) and P(o-tol)3 (70 mg, 0.23 mmol) were added simultaneously, and the mixture was de-oxygenated a third time for 5 min. The mixture was heated to reflux overnight, then allowed to cool. The mixture was diluted with EtOAc (100 mL), washed with H2O (50 mL), dried over Na2SO4, filtered and concentrated to an orange residue. Purification by flash column chromatography (silica gel, CH2Cl2/MeOH, 98:2 to 97:3) gave the title compound (0.24 g, 51%) as a light pink solid: MS (ESI) m/e 418 (M+H)+.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07879872B2 |
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| Source dataset | uspto-grants-2011_02 |
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| ORD ID | ord-1d4fb734d62442da8fb7665dd55ce7e9 |
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| Source note | uspto-grants-2011_02 |
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