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Hydrochloric Acid → 3-[4-(azetidine-1-carbonyl)-2-fluorophenoxy]-5-(1-hydroxypropan-2-yloxy)-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide

HRID 112810
Notes
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Reaction equation

HRID 112810 reaction equation
[C:43](=[O:44])([OH:45])[O-:46].[CH3:48][OH:49].[ClH:1].[N:2]1([C:6](=[O:7])[c:8]2[cH:9][c:10]([F:42])[c:11]([O:12][c:13]3[cH:14][c:15]([C:16](=[O:17])[NH:18][c:19]4[n:20][c:21]([CH3:24])[n:22][s:23]4)[cH:25][c:26]([O:28][CH:29]([CH2:30][O:31][Si:32]([C:33]([CH3:34])([CH3:35])[CH3:36])([CH3:37])[CH3:38])[CH3:39])[cH:27]3)[cH:40][cH:41]2)[CH2:3][CH2:4][CH2:5]1.[Na+:47]>>[N:2]1([C:6](=[O:7])[c:8]2[cH:9][c:10]([F:42])[c:11]([O:12][c:13]3[cH:14][c:15]([C:16](=[O:17])[NH:18][c:19]4[n:20][c:21]([CH3:24])[n:22][s:23]4)[cH:25][c:26]([O:28][CH:29]([CH2:30][OH:31])[CH3:39])[cH:27]3)[cH:40][cH:41]2)[CH2:3][CH2:4][CH2:5]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium IonHCID 691934433-[4-(azetidine-1-carbonyl)-2-fluorophenoxy]-5-[1-[tert-butyl(dimethyl)silyl]oxypropan-2-yloxy]-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide

Product 1

HCID 178434793
3-[4-(azetidine-1-carbonyl)-2-fluorophenoxy]-5-(1-hydroxypropan-2-yloxy)-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide

Sources & evidence

ORD record
ord-359b5b1f244d420d9cdb30658a0fa746
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes