1-Methyl-4,4'-bipiperidine → 2-(4-chloro-3-trifluoromethyl-benzyl)-1-(1'-methyl-[4,4']bipiperidinyl-1-yl)-4-[4-(2-oxo-1,4-dihydro-2H-quinazolin-3-yl)-piperidin-1-yl]-butan-1,4-dione

HRID 945330Notes

Reaction equation

HRID 945330 reaction equation
[CH3:74][N:75]1[CH2:76][CH2:77][CH:78]([CH:81]2[CH2:82][CH2:83][NH:84][CH2:85][CH2:86]2)[CH2:79][CH2:80]1.[Cl:1][c:2]1[c:3]([C:34]([F:35])([F:36])[F:37])[cH:4][c:5]([CH2:6][CH:7]([C:8]([O:10][CH3:9])=[O:11])[CH2:12][C:13]([N:14]2[CH2:15][CH2:16][CH:17]([N:20]3[C:21](=[O:30])[NH:22][c:23]4[cH:24][cH:25][cH:26][cH:27][c:28]4[CH2:29]3)[CH2:18][CH2:19]2)=[O:31])[cH:32][cH:33]1.[Cl:38][c:39]1[cH:40][cH:41][c:42]([CH2:43][CH:44]([CH2:45][C:46](=[O:47])[N:48]2[CH2:49][CH2:50][CH:51]([N:52]3[CH2:53][c:54]4[c:55]([cH:56][cH:57][cH:58][cH:59]4)[NH:60][C:61]3=[O:62])[CH2:63][CH2:64]2)[C:65]([OH:66])=[O:67])[cH:68][c:69]1[C:70]([F:71])([F:72])[F:73]>>[Cl:1][c:2]1[c:3]([C:34]([F:35])([F:36])[F:37])[cH:4][c:5]([CH2:6][CH:7]([C:8](=[O:10])[N:84]2[CH2:83][CH2:82][CH:81]([CH:78]3[CH2:77][CH2:76][N:75]([CH3:74])[CH2:80][CH2:79]3)[CH2:86][CH2:85]2)[CH2:12][C:13]([N:14]2[CH2:15][CH2:16][CH:17]([N:20]3[C:21](=[O:30])[NH:22][c:23]4[cH:24][cH:25][cH:26][cH:27][c:28]4[CH2:29]3)[CH2:18][CH2:19]2)=[O:31])[cH:32][cH:33]1

Participants

4

Reactant 3

HCID 71830411-Methyl-4,4'-bipiperidineHCID 68589951methyl 2-(4-chloro-3-trifluoromethyl-benzyl)-4-oxo-4-[4-(2-oxo-1,4-dihydro-2H-quinazolin-3-yl)-piperidin-1-yl]-butanoateHCID 685923932-(4-chloro-3-trifluoromethyl-benzyl)-4-oxo-4-[4-(2-oxo-1,4-dihydro-2H-quinazolin-3-yl)-piperidin-1-yl]-butanoic acid

Product 1

HCID 578482172-(4-chloro-3-trifluoromethyl-benzyl)-1-(1'-methyl-[4,4']bipiperidinyl-1-yl)-4-[4-(2-oxo-1,4-dihydro-2H-quinazolin-3-yl)-piperidin-1-yl]-butan-1,4-dione

Sources & evidence

ORD record
ord-ad8229ba5c594a81bb1af98ce9b6212a
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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