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Acetamide → HCID 23383154, compound

HRID 2223752
Notes
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Reaction equation

HRID 2223752 reaction equation
[Br:1][C:2]1[NH:3][C:4]2[CH:10]=[C:9]([Cl:11])[C:8]([Cl:12])=[CH:7][C:5]=2[N:6]=1.C(N)(=O)C.O([Si](C)(C)C)S(C(F)(F)F)(=O)=O.C(O[C@@H:33]1[O:50][CH2:49][C@@H:44]([O:45][C:46](=[O:48])[CH3:47])[C@@H:39]([O:40][C:41](=[O:43])[CH3:42])[C@H:34]1[O:35][C:36](=[O:38])[CH3:37])(=O)C.C(=O)(O)[O-].[Na+]>ClCCCl>[Br:1][C:2]1[N:3]([C@@H:49]2[O:50][CH2:33][C@@H:34]([O:35][C:36](=[O:38])[CH3:37])[C@@H:39]([O:40][C:41](=[O:43])[CH3:42])[C@H:44]2[O:45][C:46](=[O:48])[CH3:47])[C:4]2[CH:10]=[C:9]([Cl:11])[C:8]([Cl:12])=[CH:7][C:5]=2[N:6]=1
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

7

Reactant 5

HCID 178AcetamideHCID 65367Trimethylsilyl triflateHCID 97336beta-D-Ribopyranose, 1,2,3,4-tetraacetateHCID 4660172-bromo-5,6-dichloro-1H-benzimidazoleHCID 516892Sodium Bicarbonate

Product 1

HCID 23383154HCID 23383154, compound
Yield 56%

Reagents, catalysts & solvents 1

HCID 111,2-DichloroethaneSolvent

Procedure

2-Bromo-5,6-dichlorobenzimidazole (4.0 g, 15 mmol), N,O-bis(trimethylsiyl) acetamide (Aldrich, 3.7 mL, 15 mmol), and 1,2-dichloroethane (Aldrich Sure Seal, 75 mL) were combined and refluxed under nitrogen for 0.5 h. The solution was cooled to room temperature and trimethylsilyl triflate (Aldrich, 3.2 ml, 16 mmol) was added. Immediately, 4.8 g (15 mmol) solid 1,2,3,4-tetra-O-acetyl-b-D-ribopyranose (beta-D-ribopyranose 1,2,3,4-tetraacetate, Aldrich, Milwaukee) was added. The solution was stirred under nitrogen at reflux for 0.5 h, then poured into 7% aqueous sodium bicarbonate and extracted with dichloromethane. The organic layers was dried with magnesium sulfate (anhyd.), filtered, and evaporated. The crude residue was purified on a silica gel column (5×20 cm, 230-400 mesh) with CH2Cl2 to give 2-bromo-5,6-dichloro-1-(2,3,4tri-O-acetyl-β-D-ribopyranosyl)-1H-benzimidazole which was fractionated in two parts based on elution. The faster product fraction was impure (1.9 g) and purified by a second column to give 1.4 g (2.7 mmol); the slower product fraction was (3.0 g, 5.7 mmol) for a total yield of 56%; m.p. 100-110° C.; 1H NMR (DMSO-d6) δ 8.39 (s, 1H), 7.91 (s, 1H), 5.95-5.92 (d, 1H, J=9.6 Hz), 5.73-5.70 (d, 1H, J=9.6 Hz), 5.67 (bs, 2H), 4.13-4.09 (dd, 1H, J=6.3 Hz and J=5.8 Hz), 4.00-3.95 (overlapping dd, 1H), 2.19 (s, 3H), 1.98 (s, 3H), 1.74 (s, 3H).

Workup

  1. temperaturerefluxed under nitrogen for 0.5 h
  2. temperatureat reflux for 0.5 h
  3. extractionextracted with dichloromethane
  4. dry with materialThe organic layers was dried with magnesium sulfate (anhyd.)
  5. filtrationfiltered
  6. customevaporated
  7. customThe crude residue was purified on a silica gel column (5×20 cm, 230-400 mesh) with CH2Cl2

Sources & evidence

ORD record
ord-9eb09ea6c2b844e0968dfc106aa44eb2
Source dataset
uspto-grants-2008_05
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US07375235B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes