Hydrochloric Acid → HCID 86711101, compound

HRID 1056588Notes

Reaction equation

HRID 1056588 reaction equation
C(OC([NH:8][CH:9]([CH:48]([CH3:50])[CH3:49])[C:10]([O:12][CH:13]([N:15]1[C:19]2=[N:20][CH:21]=[C:22]([C:24]3[CH:29]=[CH:28][C:27]([Cl:30])=[CH:26][CH:25]=3)[CH:23]=[C:18]2[C:17]([C:31](=[O:47])[C:32]2[C:37]([F:38])=[CH:36][CH:35]=[C:34]([NH:39][S:40]([CH2:43][CH2:44][CH3:45])(=[O:42])=[O:41])[C:33]=2[F:46])=[CH:16]1)[CH3:14])=[O:11])=O)(C)(C)C.Cl>CCOC(C)=O>[ClH:30].[NH2:8][CH:9]([CH:48]([CH3:49])[CH3:50])[C:10]([O:12][CH:13]([N:15]1[C:19]2=[N:20][CH:21]=[C:22]([C:24]3[CH:29]=[CH:28][C:27]([Cl:30])=[CH:26][CH:25]=3)[CH:23]=[C:18]2[C:17]([C:31](=[O:47])[C:32]2[C:37]([F:38])=[CH:36][CH:35]=[C:34]([NH:39][S:40]([CH2:43][CH2:44][CH3:45])(=[O:41])=[O:42])[C:33]=2[F:46])=[CH:16]1)[CH3:14])=[O:11]

Participants

4

Reactant 2

HCID 313Hydrochloric AcidHCID 86711100HCID 86711100, compound

Product 1

HCID 86711101HCID 86711101, compoundYield 114.9%

Reagents, catalysts & solvents 1

HCID 8857Ethyl AcetateSolvent

Procedure

A mixture of 1-(5-(4-chlorophenyl)-3-(2,6-difluoro-3-(propylsulfonamido)benzoyl)-1H-pyrrolo[2,3-b]pyridin-1-yl)ethyl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate (0.29 g, 0.39 mmol) and a saturated solution of HCl in EtOAc (4 mL) was stirred at rt for 2 h. The mixture was filtered to give the title compound as a white solid (0.15 g, 57%). The title compound was characterized by LC-MS and 1H NMR as shown below:

Workup

  1. filtrationThe mixture was filtered

Sources & evidence

ORD record
ord-c85dc1501e6f4836bbc9124b2f5f5f1a
Source dataset
uspto-grants-2016_07
Patent number
US09399639B2

Reaction notes

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