1,4'-Bipiperidine → 2-[[4-Amino-3-chloro-5-(trifluoromethyl)phenyl]methyl]-4-[4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidin-1-yl]-1-(4-piperidin-1-ylpiperidin-1-yl)butane-1,4-dione
Reaction equation
[N:38]1([CH:44]2[CH2:45][CH2:46][NH:47][CH2:48][CH2:49]2)[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]1.[NH2:1][c:2]1[c:3]([Cl:37])[cH:4][c:5]([CH2:6][CH:7]([C:8](=[O:9])[OH:10])[CH2:11][C:12]([N:13]2[CH2:14][CH2:15][CH:16]([N:19]3[C:20](=[O:29])[NH:21][c:22]4[cH:23][cH:24][cH:25][cH:26][c:27]4[CH2:28]3)[CH2:17][CH2:18]2)=[O:30])[cH:31][c:32]1[C:33]([F:34])([F:35])[F:36]>>[NH2:1][c:2]1[c:3]([Cl:37])[cH:4][c:5]([CH2:6][CH:7]([C:8](=[O:9])[N:47]2[CH2:46][CH2:45][CH:44]([N:38]3[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]3)[CH2:49][CH2:48]2)[CH2:11][C:12]([N:13]2[CH2:14][CH2:15][CH:16]([N:19]3[C:20](=[O:29])[NH:21][c:22]4[cH:23][cH:24][cH:25][cH:26][c:27]4[CH2:28]3)[CH2:17][CH2:18]2)=[O:30])[cH:31][c:32]1[C:33]([F:34])([F:35])[F:36]Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-b87455e072264ad6925e59760f22f8b5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)