Hydrochloric Acid → 1-Cyclopentyl-7-(4-diethylamino-butylamino)-3-(2,6-difluoro-3-hydroxy-5-methoxy phenyl)-3,4-dihydro-1H-pyrimido[4,5-d]pyrimidin-2-one
Reaction equation
[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[CH:1]1([N:6]2[C:7](=[O:38])[N:8]([c:26]3[c:27]([F:37])[c:28]([O:35][CH3:36])[cH:29][c:30]([O:33][CH3:34])[c:31]3[F:32])[CH2:9][c:10]3[c:11]2[n:12][c:13]([NH:16][CH2:17][CH2:18][CH2:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25])[n:14][cH:15]3)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Cl:39][CH2:40][Cl:41].[ClH:43].[OH2:42]>>[CH:1]1([N:6]2[C:7](=[O:38])[N:8]([c:26]3[c:27]([F:37])[c:28]([O:35][CH3:36])[cH:29][c:30]([OH:33])[c:31]3[F:32])[CH2:9][c:10]3[c:11]2[n:12][c:13]([NH:16][CH2:17][CH2:18][CH2:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25])[n:14][cH:15]3)[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-38a53bb781564c42a6c4dc014cab9331
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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