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

HRID 687485

Reaction equation

HRID 687485 reaction equation
[CH2:69]1[O:70][CH2:71][CH2:72][CH2:73]1.[CH3:41][n:42]1[n:43][cH:44][cH:45][c:46]1[CH2:47][CH2:48][OH:49].[Cl:74][CH2:75][Cl:76].[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][CH: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:50]1([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[cH:64][cH:65][cH:66][cH:67][cH:68]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][CH: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

7

Reactant 6

HCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 75555Diisopropyl diazene-1,2-dicarboxylateHCID 218324192-(1-methyl-1H-pyrazol-5-yl)ethan-1-olHCID 367300784-(1-(3-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidin-4-yl)phenol

Product 1

HCID 426358766-[4-[4-[2-(1-methyl-1H-pyrazol-5-yl)ethoxy]phenyl]piperidin-1-yl]-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazine

Sources & evidence

ORD record
ord-4b3d5a27756a430e8fa562aca727b7e6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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