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Bicarbonate Ion → 2-[4-(3-Aminopyrrolidin-1-yl)-6-fluoroquinazolin-2-yl]phenol

HRID 2348004
Notes
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Reaction equation

HRID 2348004 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH:8]1[CH2:9][N:10]([c:13]2[n:14][c:15](-[c:24]3[c:25]([OH:30])[cH:26][cH:27][cH:28][cH:29]3)[n:16][c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][c:22]23)[CH2:11][CH2:12]1)([CH3:5])([CH3:6])[CH3:31].[Cl:44][CH2:45][Cl:46].[F:32][C:33]([F:34])([F:35])[C:36]([OH:37])=[O:38].[Na+:43].[O-:39][C:40]([OH:41])=[O:42]>>[NH2:7][CH:8]1[CH2:9][N:10]([c:13]2[n:14][c:15](-[c:24]3[c:25]([OH:30])[cH:26][cH:27][cH:28][cH:29]3)[n:16][c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][c:22]23)[CH2:11][CH2:12]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 136651765tert-butyl N-[1-[6-fluoro-2-(2-hydroxyphenyl)quinazolin-4-yl]pyrrolidin-3-yl]carbamate

Product 1

HCID 1363653772-[4-(3-Aminopyrrolidin-1-yl)-6-fluoroquinazolin-2-yl]phenol

Sources & evidence

ORD record
ord-1249eec99ce74df2b50302dca0a66640
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes