Dichloromethane → 4-amino-N-(1-(4-chlorophenyl)-3-(dimethylamino)-3-oxopropyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

HRID 160705Notes

Reaction equation

HRID 160705 reaction equation
[Cl:48][CH2:49][Cl:50].[Cl:8][c:9]1[cH:10][cH:11][c:12]([CH:15]([CH2:16][C:17](=[O:18])[N:19]([CH3:20])[CH3:21])[NH:22][C:23](=[O:24])[C:25]2([NH:40][C:41](=[O:42])[O:43][C:44]([CH3:45])([CH3:46])[CH3:47])[CH2:26][CH2:27][N:28]([c:31]3[c:32]4[c:33]([n:34][cH:35][n:36]3)[nH:37][cH:38][cH:39]4)[CH2:29][CH2:30]2)[cH:13][cH:14]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7]>>[Cl:8][c:9]1[cH:10][cH:11][c:12]([CH:15]([CH2:16][C:17](=[O:18])[N:19]([CH3:20])[CH3:21])[NH:22][C:23](=[O:24])[C:25]2([NH2:40])[CH2:26][CH2:27][N:28]([c:31]3[c:32]4[c:33]([n:34][cH:35][n:36]3)[nH:37][cH:38][cH:39]4)[CH2:29][CH2:30]2)[cH:13][cH:14]1

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 57750350tert-butyl 4-(1-(4-chlorophenyl)-3-(dimethylamino)-3-oxopropylcarbamoyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-4-ylcarbamate

Product 1

HCID 577504204-amino-N-(1-(4-chlorophenyl)-3-(dimethylamino)-3-oxopropyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

Sources & evidence

ORD record
ord-3e8014c22f5245dd8c95fc5b22000f40
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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