Trifluoroacetic acid → HCID 178464817, compound

HRID 2053885Notes

Reaction equation

C(OC([NH:8][CH2:9][CH:10]1[C:15](=[O:16])[NH:14][CH2:13][CH2:12][N:11]1[C:17]([C:19]1[CH:39]=[CH:38][C:22]([C:23]([NH:25][CH:26]([C:28]2[NH:32][C:31]3[CH:33]=[CH:34][C:35]([Cl:37])=[CH:36][C:30]=3[N:29]=2)[CH3:27])=[O:24])=[CH:21][C:20]=1[Cl:40])=[O:18])=O)(C)(C)C.FC(F)(F)C(O)=O.ClCl>>[NH2:8][CH2:9][CH:10]1[C:15](=[O:16])[NH:14][CH2:13][CH2:12][N:11]1[C:17]([C:19]1[CH:39]=[CH:38][C:22]([C:23]([NH:25][CH:26]([C:28]2[NH:32][C:31]3[CH:33]=[CH:34][C:35]([Cl:37])=[CH:36][C:30]=3[N:29]=2)[CH3:27])=[O:24])=[CH:21][C:20]=1[Cl:40])=[O:18]

Participants

Reactant 3

HCID 6422Trifluoroacetic acid

HCID 24526Chlorine

HCID 178464818HCID 178464818, compound

Product 1

HCID 178464817HCID 178464817, compoundYield 91%

Procedure

Prepared analogously to Example 17 from 4-(2-tert-butoxycarbonylaminomethyl-3-oxopiperazin-1-ylcarbonyl)-3-chloro-N-[1-(5-chloro-1H-benzimidazol-2-yl)ethyl]benzamide and trifluoroacetic acid. Yield: 91%; C22H22Cl2N6O3 (489.36); mass spectrum: (M+H)+=489/491/493 (chlorine isotope).

Sources & evidence

ORD record: ord-cc9197eaf0914c5cb33087794c647b0d
Source dataset: uspto-grants-2008_02
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US07326791B2

Reaction notes

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