Acetone → 2-Butyl-6-(1-hydroxyethyl)-3-[[2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-4(3H)-quinazolinone

HRID 123743Notes

Reaction equation

HRID 123743 reaction equation
[Br:19][CH2:20][c:21]1[cH:22][cH:23][c:24](-[c:27]2[c:28](-[c:33]3[n:34][n:35][n:36][n:37]3[C:38]([c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)([c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[c:51]3[cH:52][cH:53][cH:54][cH:55][cH:56]3)[cH:29][cH:30][cH:31][cH:32]2)[cH:25][cH:26]1.[C:57](=[O:58])([O-:59])[O-:60].[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[nH:6][c:7]2[cH:8][cH:9][c:10]([CH:16]([CH3:17])[OH:18])[cH:11][c:12]2[c:13](=[O:15])[n:14]1.[CH3:63][C:64](=[O:65])[CH3:66].[K+:61].[K+:62]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]2[cH:8][cH:9][c:10]([CH:16]([CH3:17])[OH:18])[cH:11][c:12]2[c:13](=[O:15])[n:14]1[CH2:20][c:21]1[cH:22][cH:23][c:24](-[c:27]2[c:28](-[c:33]3[n:34][n:35][n:36][n:37]3[C:38]([c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)([c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[c:51]3[cH:52][cH:53][cH:54][cH:55][cH:56]3)[cH:29][cH:30][cH:31][cH:32]2)[cH:25][cH:26]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 100534615-(4'-(Bromomethyl)(1,1'-biphenyl)-2-yl)-1-trityl-1H-tetraazoleHCID 178441847HCID 178441847, compound

Product 1

HCID 200793502-Butyl-6-(1-hydroxyethyl)-3-[[2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-4(3H)-quinazolinone

Sources & evidence

ORD record
ord-812f6496f68747498447341923d6575d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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