Hydrochloric Acid → HCID 69159706, compound

HRID 1057497Notes

Reaction equation

HRID 1057497 reaction equation
C(O[N:6]([CH2:19][C:20]1[CH:25]=[CH:24][C:23]([CH2:26][N:27]2[CH2:33][CH2:32][C:31]3[CH:34]=[CH:35][CH:36]=[CH:37][C:30]=3[CH:29]([CH2:38][C:39]([O:41]C)=[O:40])[CH2:28]2)=[CH:22][CH:21]=1)[C:7]([CH:9]=[N:10][NH:11][C:12]([O:14][C:15]([CH3:18])([CH3:17])[CH3:16])=[O:13])=[O:8])(C)(C)C.[OH-].[Na+].Cl>CO>[C:15]([O:14][C:12]([NH:11][N:10]=[CH:9][C:7]([NH:6][CH2:19][C:20]1[CH:25]=[CH:24][C:23]([CH2:26][N:27]2[CH2:33][CH2:32][C:31]3[CH:34]=[CH:35][CH:36]=[CH:37][C:30]=3[CH:29]([CH2:38][C:39]([OH:41])=[O:40])[CH2:28]2)=[CH:22][CH:21]=1)=[O:8])=[O:13])([CH3:18])([CH3:16])[CH3:17]

Participants

5

Reactant 3

HCID 313Hydrochloric AcidHCID 14798Sodium HydroxideHCID 131723752HCID 131723752, compound

Product 1

HCID 69159706HCID 69159706, compound

Reagents, catalysts & solvents 1

HCID 887MethanolSolvent

Procedure

To a stirring solution Methyl 2-[3-({4-[((tert-butoxy)-N-{[(tert-butoxy)carbonylamino]iminomethyl}carbonylamino)methyl]phenyl}methyl)-1H,2H,4H,5H-benzo[d]azepinyl]acetate in methanol (0.1 M) was added 1N NaOH (3 eq). After 18 hrs, the reaction was neutralized with 10% HCl, concentrated by rotary evaporation and purified by recrystalization from 2% MeOH/CH2Cl2. EI-MS m/z 466.

Workup

  1. concentrationconcentrated by rotary evaporation
  2. custompurified by recrystalization from 2% MeOH/CH2Cl2

Sources & evidence

ORD record
ord-d54bc9d9d67b4e26a9225e58cc638a28
Source dataset
uspto-grants-2003_02
Patent number
US06514964B1

Reaction notes

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