Dimethylformamide → 4-chloro-N-({4-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]tetrahydro-2H-pyran-4-yl}methyl)phthalazin-1-amine

HRID 100210

Reaction equation

HRID 100210 reaction equation
[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[Cl:24][c:25]1[n:26][n:27][c:28]([Cl:35])[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]12.[N:1]1([CH2:6][CH2:7][CH2:8][O:9][c:10]2[cH:11][cH:12][c:13]([C:16]3([CH2:22][NH2:23])[CH2:17][CH2:18][O:19][CH2:20][CH2:21]3)[cH:14][cH:15]2)[CH2:2][CH2:3][CH2:4][CH2:5]1>>[N:1]1([CH2:6][CH2:7][CH2:8][O:9][c:10]2[cH:11][cH:12][c:13]([C:16]3([CH2:22][NH:23][c:28]4[n:27][n:26][c:25]([Cl:24])[c:34]5[c:29]4[cH:30][cH:31][cH:32][cH:33]5)[CH2:17][CH2:18][O:19][CH2:20][CH2:21]3)[cH:14][cH:15]2)[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

5

Reactant 4

HCID 6228DimethylformamideHCID 784901,4-DichlorophthalazineHCID 81531DiisopropylethylamineHCID 11645410(4-[4-(3-Pyrrolidin-1-ylpropoxy)phenyl]tetrahydropyran-4-yl}methylamine

Product 1

HCID 866019064-chloro-N-({4-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]tetrahydro-2H-pyran-4-yl}methyl)phthalazin-1-amine

Sources & evidence

ORD record
ord-d670a5e890a94eaf9f256870a87fd467
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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