Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ammonia | HCID 222 | — |
| Reactant | Methanol | HCID 887 | — |
| Reactant | HCID 86601253 | HCID 86601253 | — |
| Solvent | O-Xylene | HCID 7237 | — |
| Product | HCID 59644548 | HCID 59644548 | — |
Reaction Steps
Combine 4-[4-benzyl-4-(toluene-4-sulfonyl)-4,5-dihydro-oxazol-5-yl]-1-(3,5-bis-trifluoromethyl-benzyl)-5-phenyl-1H-[1,2,3]triazole (0.084 mmol), 1.0 mL of xylene, and 7N solution of ammonia in methanol (48.0 μL, 0.337 mmol). Heat in a sealed pyrex tube to 136° C. After 18 hours, cool to RT, and concentrate the mixture to 1.0 mL and apply to a 2 mm chromatotron plate with CH2Cl2 and elute with a EtOAc/hexanes gradient to provide the title compound. Exact Mass 527.2: mass spectrum (IS): m/z=529.1 (M+1), 527.1 (M−1); 1H NMR (250 MHz, CDCl3) 7.84 (s, 1H), 7.67 (s, 1H), 7.65-7.05 (m, 13H), 5.60 (s, 2H), 4.28 (s, 2H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07320994B2 |
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| Source dataset | uspto-grants-2008_01 |
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| ORD ID | ord-c708b183c7664e30bb3e5234bc7c6625 |
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| Source note | uspto-grants-2008_01 |
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