Dichloromethane → HCID 178491735, compound

HRID 202005Notes

Reaction equation

HRID 202005 reaction equation
[CH2:78]([Cl:79])[Cl:80].[CH3:34][O:35][c:36]1[cH:37][c:38]([CH3:58])[c:39]([S:43](=[O:44])(=[O:45])[N:46]2[CH:47]([CH2:52][O:53][CH2:54][C:55]([OH:56])=[O:57])[CH2:48][CH2:49][CH2:50][CH2:51]2)[c:40]([CH3:42])[cH:41]1.[CH:69]([N:70]([CH2:71][CH3:72])[CH:73]([CH3:74])[CH3:75])([CH3:76])[CH3:77].[F:27][C:28]([F:29])([F:30])[C:31]([OH:32])=[O:33].[N:1]1([CH2:5][CH2:6][O:7][C:8]2([c:21]3[cH:22][n:23][cH:24][cH:25][cH:26]3)[CH2:9][CH2:10][N:11]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:12][CH2:13]2)[CH2:2][CH2:3][CH2:4]1.[OH:59][n:60]1[c:61]2[c:62]([cH:63][cH:64][cH:65][cH:66]2)[n:67][n:68]1>>[N:1]1([CH2:5][CH2:6][O:7][C:8]2([c:21]3[cH:22][n:23][cH:24][cH:25][cH:26]3)[CH2:9][CH2:10][N:11]([C:14](=[O:15])[CH2:54][O:53][CH2:52][CH:47]3[N:46]([S:43]([c:39]4[c:38]([CH3:58])[cH:37][c:36]([O:35][CH3:34])[cH:41][c:40]4[CH3:42])(=[O:44])=[O:45])[CH2:51][CH2:50][CH2:49][CH2:48]3)[CH2:12][CH2:13]2)[CH2:2][CH2:3][CH2:4]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 574368002-((1-(4-Methoxy-2,6-dimethylphenylsulfonyl)piperidin-2-yl)methoxy)acetic acidHCID 57916280Tert-butyl 4-(2-(azetidin-1-yl)ethoxy)-4-(pyridin-3-yl)piperidine-1-carboxylate

Product 1

HCID 178491735HCID 178491735, compound

Sources & evidence

ORD record
ord-f9faa6e2fc7c4709bacaefffb2edfc07
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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