HCID 59275368, compound → HCID 59275776, compound

HRID 1671944Notes

Reaction equation

HRID 1671944 reaction equation
[F:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[O:9][C:10]3[CH:21]=[C:20]([N+:22]([O-:24])=[O:23])[C:19]([C:25]4[CH:30]=[C:29]([C:31](=[O:42])[NH:32][C:33]5([C:36]6[CH:41]=[CH:40][CH:39]=[CH:38][CH:37]=6)[CH2:35][CH2:34]5)[CH:28]=[CH:27][C:26]=4[CH3:43])=[CH:18][C:11]=3[C:12]=2[C:13]([O:15]CC)=[O:14])=[CH:4][CH:3]=1>CO>[F:1][C:2]1[CH:3]=[CH:4][C:5]([C:8]2[O:9][C:10]3[CH:21]=[C:20]([N+:22]([O-:24])=[O:23])[C:19]([C:25]4[CH:30]=[C:29]([C:31](=[O:42])[NH:32][C:33]5([C:36]6[CH:37]=[CH:38][CH:39]=[CH:40][CH:41]=6)[CH2:34][CH2:35]5)[CH:28]=[CH:27][C:26]=4[CH3:43])=[CH:18][C:11]=3[C:12]=2[C:13]([OH:15])=[O:14])=[CH:6][CH:7]=1

Participants

3

Reactant 1

HCID 59275368HCID 59275368, compound

Product 1

HCID 59275776HCID 59275776, compound

Reagents, catalysts & solvents 1

HCID 887MethanolSolvent2×

Procedure

Prepared by the hydrolysis of ethyl 2-(4-fluorophenyl)-5-(2-methyl-5-(1-phenylcyclopropylcarbamoyl)phenyl)-6-nitrobenzofuran-3-carboxylate. LC/MS were performed by using Shimadzu-VP instrument with UV detection at 220 nm and Waters Micromass. HPLC method: Solvent A=10% MeOH-90% H2O-0.1% TFA, Solvent B=90% MeOH-10% H2O-0.1% TFA, Start % B=0, Final % B=100, Gradient time=2 min, Stop time=3 min, Flow Rate=4 ml/min, Column: Xterra MS 7 um, C18, 3.0×50 mm; (ES+) m/z (M+H)+=551.34, HPLC Rt=1.895 min.

Workup

  1. customB=100, Gradient time=2 min
  2. customtime=3 min, Flow Rate=4 ml/min, Column

Sources & evidence

ORD record
ord-eede614ab0a04240af9bb13852413ed8
Source dataset
uspto-grants-2011_08
Patent number
US07994171B2

Reaction notes

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