tert-butyl 4-[7-[2-(1-phenylethylamino)-4-pyridinyl]-8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]-3,6-dihydro-2H-pyridine-1-carboxylate → [1-[7-[2-(1-Phenylethylamino)-4-pyridinyl]-8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]pyrrolidin-2-yl]methanol

HRID 1141785Notes

Reaction equation

HRID 1141785 reaction equation
[C:34]([O:35][C:36]([N:37]1[CH2:38][CH:39]=[C:40]([c:41]2[n:42]3[cH:43][n:44][n:45][c:46]3[c:47](-[c:48]3[cH:49][cH:50][cH:51][c:52]([C:53]([F:54])([F:55])[F:56])[cH:57]3)[c:58](-[c:59]3[cH:60][cH:61][n:62][c:63]([NH:72][CH:73]([CH3:74])[c:75]4[cH:76][cH:77][cH:78][cH:79][cH:80]4)[cH:64]3)[n:65]2)[CH2:66][CH2:67]1)=[O:68])([CH3:69])([CH3:70])[CH3:71].[OH:1][CH2:2][CH:3]1[N:4]([c:8]2[n:9][c:10](-[c:27]3[cH:28][c:29]([Cl:33])[n:30][cH:31][cH:32]3)[c:11](-[c:17]3[cH:18][c:19]([C:23]([F:24])([F:25])[F:26])[cH:20][cH:21][cH:22]3)[c:12]3[n:13]2[cH:14][n:15][n:16]3)[CH2:5][CH2:6][CH2:7]1>>[OH:1][CH2:2][CH:3]1[N:4]([c:8]2[n:9][c:10](-[c:27]3[cH:28][c:29]([NH:72][CH:73]([CH3:74])[c:75]4[cH:76][cH:77][cH:78][cH:79][cH:80]4)[n:30][cH:31][cH:32]3)[c:11](-[c:17]3[cH:18][c:19]([C:23]([F:24])([F:25])[F:26])[cH:20][cH:21][cH:22]3)[c:12]3[n:13]2[cH:14][n:15][n:16]3)[CH2:5][CH2:6][CH2:7]1

Participants

3

Reactant 2

HCID 22346585tert-butyl 4-[7-[2-(1-phenylethylamino)-4-pyridinyl]-8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]-3,6-dihydro-2H-pyridine-1-carboxylateHCID 22346590[1-[7-(2-Chloro-4-pyridinyl)-8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]pyrrolidin-2-yl]methanol

Product 1

HCID 22346615[1-[7-[2-(1-Phenylethylamino)-4-pyridinyl]-8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-yl]pyrrolidin-2-yl]methanol

Sources & evidence

ORD record
ord-86ab7027cdb541aa8a4ef59f6e4687e4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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