Dimethylformamide → (2-Cyclopentylthiazol-4-yl)(9-(3-fluoro-5-(2-hydroxyethyl)benzyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone

HRID 2148674Notes

Reaction equation

HRID 2148674 reaction equation
[CH3:60][CH2:61][N:62]([CH2:63][CH3:64])[CH2:65][CH3:66].[CH:47]1([c:52]2[s:53][cH:54][c:55]([C:57](=[O:58])[OH:59])[n:56]2)[CH2:48][CH2:49][CH2:50][CH2:51]1.[O:25]1[CH2:26][CH2:27][NH:28][CH2:29][C:30]12[CH2:31][CH2:32][N:33]([CH2:36][c:37]1[cH:38][c:39]([CH2:44][CH2:45][OH:46])[cH:40][c:41]([F:43])[cH:42]1)[CH2:34][CH2:35]2.[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[O:25]1[CH2:26][CH2:27][N:28]([C:57]([c:55]2[cH:54][s:53][c:52]([CH:47]3[CH2:48][CH2:49][CH2:50][CH2:51]3)[n:56]2)=[O:58])[CH2:29][C:30]12[CH2:31][CH2:32][N:33]([CH2:36][c:37]1[cH:38][c:39]([CH2:44][CH2:45][OH:46])[cH:40][c:41]([F:43])[cH:42]1)[CH2:34][CH2:35]2

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 579889902-(3-(1-Oxa-4,9-diazaspiro[5.5]undecan-9-ylmethyl)-5-fluorophenyl)ethanolHCID 579891322-Cyclopentylthiazole-4-carboxylic acid

Product 1

HCID 57989165(2-Cyclopentylthiazol-4-yl)(9-(3-fluoro-5-(2-hydroxyethyl)benzyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone

Sources & evidence

ORD record
ord-b9aca724c7854059a889db3ae0cfed21
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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