Dichloromethane → HCID 68515015, compound

HRID 203481Notes

Reaction equation

HRID 203481 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][c:10]([NH:27][CH:28]3[CH2:29][CH2:30][N:31]([CH3:34])[CH2:32][CH2:33]3)[c:11]3[c:12]2[n:13][cH:14][cH:15][c:16]3[O:17][c:18]2[c:19]([F:26])[cH:20][c:21]([NH2:25])[c:22]([Cl:24])[cH:23]2)[cH:35][cH:36]1.[CH3:54][CH2:55][N:56]([CH2:57][CH3:58])[CH2:59][CH3:60].[CH3:61][CH2:62][N:63]=[C:64]=[N:65][CH2:66][CH2:67][CH2:68][N:69]([CH3:70])[CH3:71].[Cl:82][CH2:83][Cl:84].[F:37][c:38]1[cH:39][cH:40][c:41](-[n:44]2[n:45][cH:46][cH:47][c:48]([C:51](=[O:52])[OH:53])[c:49]2=[O:50])[cH:42][cH:43]1.[OH:72][n:73]1[c:74]2[c:75]([cH:76][cH:77][cH:78][cH:79]2)[n:80][n:81]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][c:10]([NH:27][CH:28]3[CH2:29][CH2:30][N:31]([CH3:34])[CH2:32][CH2:33]3)[c:11]3[c:12]2[n:13][cH:14][cH:15][c:16]3[O:17][c:18]2[c:19]([F:26])[cH:20][c:21]([NH:25][C:51]([c:48]3[cH:47][cH:46][n:45][n:44](-[c:41]4[cH:40][cH:39][c:38]([F:37])[cH:43][cH:42]4)[c:49]3=[O:50])=[O:52])[c:22]([Cl:24])[cH:23]2)[cH:35][cH:36]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 667671712-(4-Fluorophenyl)-3-oxo-2,3-dihydropyridazine-4-carboxylic acidHCID 685163031-(4-methoxybenzyl)-4-(4-amino-5-chloro-2-fluorophenoxy)-N-(1-methylpiperidin-4-yl)-1H-pyrazolo[3,4-b]pyridin-3-amine

Product 1

HCID 68515015HCID 68515015, compound

Sources & evidence

ORD record
ord-2fa9afd72b7343d2a3226c20beffcd2b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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