Tetrahydrofuran → 6-[4-[4-[2-(1-methyl-1H-pyrazol-5-yl)ethoxy]phenyl]piperazin-1-yl]-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazine

HRID 104432Notes

Reaction equation

HRID 104432 reaction equation
[CH2:94]1[O:95][CH2:96][CH2:97][CH2:98]1.[CH3:41][n:42]1[n:43][cH:44][cH:45][c:46]1[CH2:47][CH2:48][O:49][c:50]1[cH:51][cH:52][c:53]([CH:54]2[CH2:55][CH2:56][N:57]([C:58]3=[N:70][n:62]4[c:61]([n:69][n:68][c:63]4[C:64]([F:65])([F:66])[F:67])[CH2:60][CH2:59]3)[CH2:71][CH2:72]2)[cH:73][cH:74]1.[F:15][C:16]([c:17]1[n:18][n:19][c:20]2[n:21]1[n:22][c:23]([N:26]1[CH2:27][CH2:28][N:29]([c:32]3[cH:33][cH:34][c:35]([OH:38])[cH:36][cH:37]3)[CH2:30][CH2:31]1)[cH:24][cH:25]2)([F:39])[F:40].[O:1]=[C:2]([O:3][CH:4]([CH3:5])[CH3:6])[N:7]=[N:8][C:9]([O:10][CH:11]([CH3:12])[CH3:13])=[O:14].[c:75]1([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[cH:89][cH:90][cH:91][cH:92][cH:93]1>>[F:15][C:16]([c:17]1[n:18][n:19][c:20]2[n:21]1[n:22][c:23]([N:26]1[CH2:27][CH2:28][N:29]([c:32]3[cH:33][cH:34][c:35]([O:38][CH2:48][CH2:47][c:46]4[n:42]([CH3:41])[n:43][cH:44][cH:45]4)[cH:36][cH:37]3)[CH2:30][CH2:31]1)[cH:24][cH:25]2)([F:39])[F:40]

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 75555Diisopropyl diazene-1,2-dicarboxylateHCID 300088374-[4-[3-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperazin-1-yl]phenolHCID 468938506-[4-[4-[2-(1-methyl-1H-pyrazol-5-yl)ethoxy]phenyl]piperidin-1-yl]-3-(trifluoromethyl)-7,8-dihydro[1,2,4]triazolo[4,3-b]pyridazine

Product 1

HCID 441259726-[4-[4-[2-(1-methyl-1H-pyrazol-5-yl)ethoxy]phenyl]piperazin-1-yl]-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazine

Sources & evidence

ORD record
ord-ba362f8376d348ed9c59bb01ca0bccb2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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