HCID 90411276, compound → HCID 90411786, compound

HRID 2175976Notes

Reaction equation

HRID 2175976 reaction equation
CC1C=C(C)N=C(NC23N([C:17]4([N:26]5[N:30]=[CH:29][CH:28]=[N:27]5)[CH:22]=[CH:21][C:20]([F:23])=[CH:19][CH:18]4[CH:24]=[O:25])C(CC2)CC3)N=1.FC(F)(F)C1N=CC(N[C@@H]2C[C@@H]3N[C@H]2CC3)=NC=1.[CH3:49][C:50]1[CH:55]=[C:54]([CH3:56])[N:53]=[C:52]([NH:57][CH:58]2[CH2:63][CH:62]3[NH:64][CH:59]2[CH2:60][CH2:61]3)[N:51]=1>>[CH3:56][C:54]1[CH:55]=[C:50]([CH3:49])[N:51]=[C:52]([NH:57][CH:58]2[CH2:63][CH:62]3[N:64]([C:24]([C:18]4[CH:19]=[C:20]([F:23])[CH:21]=[CH:22][C:17]=4[N:26]4[N:30]=[CH:29][CH:28]=[N:27]4)=[O:25])[CH:59]2[CH2:60][CH2:61]3)[N:53]=1

Participants

4

Reactant 3

HCID 90411276HCID 90411276, compoundHCID 90413620HCID 90413620, compoundHCID 131732989HCID 131732989, compound

Product 1

HCID 90411786HCID 90411786, compound

Procedure

(±)-(2-(((4,6-dimethylpyrimidin-2-yl)amino)-7-azabicyclo[2.2.1]heptan-7-yl)(5-fluoro-2-(2H-1,2,3-triazol-2-yl)phenyl)methanone Prepared analogous to Example 181 substituting intermediate A-1 with intermediate A-10 and (1S,2R,4R)—N-(5-(trifluoromethyl)pyrazin-2-yl)-7-azabicyclo[2.2.1]heptan-2-amine with the title compound of step B. MS (ESI) mass calcd. for C21H22FN7O, 407.2; m/z found 408.2 [M+H]+. 1H NMR (CDCl3): 8.23-7.67 (m, 2.5H), 7.54-6.93 (m, 2.5H), 6.40-6.19 (m, 1H), 4.89-4.65 (m, 1H), 4.41-3.66 (m, 2H), 2.39-1.34 (m, 12H).

Sources & evidence

ORD record
ord-e642b9b8fa7c4035833b3d306fba0d69
Source dataset
uspto-grants-2015_06
Patent number
US09062078B2

Reaction notes

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