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Acetic Acid → Methyl 1-((4-(5-chlorothiazolo[5,4-b]pyridine-2-yl)-3-fluorophenyl)methyl)azetidine-3-carboxylate

HRID 1236354
Notes
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Reaction equation

HRID 1236354 reaction equation
[C:42]([BH3-:43])#[N:44].[CH2:29]([N:30]([CH:31]([CH3:32])[CH3:33])[CH:34]([CH3:35])[CH3:36])[CH3:37].[CH3:38][C:39](=[O:40])[OH:41].[CH3:49][OH:50].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7]1)[s:8][c:9](-[c:11]1[c:12]([F:19])[cH:13][c:14]([CH:15]=[O:16])[cH:17][cH:18]1)[n:10]2.[Cl:46][CH2:47][Cl:48].[ClH:20].[NH:21]1[CH2:22][CH:23]([C:25](=[O:26])[O:27][CH3:28])[CH2:24]1.[Na+:45]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7]1)[s:8][c:9](-[c:11]1[c:12]([F:19])[cH:13][c:14]([CH2:15][N:21]3[CH2:22][CH:23]([C:25](=[O:26])[O:27][CH3:28])[CH2:24]3)[cH:17][cH:18]1)[n:10]2
ParticipantsSources & evidenceReaction notes

Participants

10

Reactant 9

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium IonHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 498716Cyano-borohydride
HCID 20132751
Methyl azetidine-3-carboxylate
HCID 866387064-(5-Chlorothiazolo[5,4-b]pyridine-2-yl)-3-fluorobenzaldehyde

Product 1

HCID 86638707Methyl 1-((4-(5-chlorothiazolo[5,4-b]pyridine-2-yl)-3-fluorophenyl)methyl)azetidine-3-carboxylate

Sources & evidence

ORD record
ord-eaac89bcb8aa48ebaee92f545313f29b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes