Dichloromethane → 4-(2-Amino-2-cyclohexyl-acetyl)-1-cyclopropanecarbonyl-octahydro-pyrrolo[3,2-b]pyrrole-3-carboxylic acid (1,2,3,4-tetrahydro-naphthalen-1-yl)-amide

HRID 193600Notes

Reaction equation

HRID 193600 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH:8]([C:9](=[O:10])[N:11]1[CH:12]2[CH:13]([CH2:14][CH2:15]1)[N:16]([C:32](=[O:33])[CH:34]1[CH2:35][CH2:36]1)[CH2:17][CH:18]2[C:19]([NH:20][CH:21]1[CH2:22][CH2:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][c:30]21)=[O:31])[CH:37]1[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42]1)([CH3:5])([CH3:6])[CH3:43].[Cl:51][CH2:52][Cl:53].[F:44][C:45]([F:46])([F:47])[C:48]([OH:49])=[O:50]>>[NH2:7][CH:8]([C:9](=[O:10])[N:11]1[CH:12]2[CH:13]([CH2:14][CH2:15]1)[N:16]([C:32](=[O:33])[CH:34]1[CH2:35][CH2:36]1)[CH2:17][CH:18]2[C:19]([NH:20][CH:21]1[CH2:22][CH2:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][c:30]21)=[O:31])[CH:37]1[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42]1

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 67280896{1-Cyclohexyl-2-[4-cyclopropanecarbonyl-6-(1,2,3,4-tetrahydro-naphthalen-1-ylcarbamoyl)-hexahydro-pyrrolo[3,2-b]pyrrol-1-yl]-2-oxo-ethyl}-carbamic acid tert-butyl ester

Product 1

HCID 672813634-(2-Amino-2-cyclohexyl-acetyl)-1-cyclopropanecarbonyl-octahydro-pyrrolo[3,2-b]pyrrole-3-carboxylic acid (1,2,3,4-tetrahydro-naphthalen-1-yl)-amide

Sources & evidence

ORD record
ord-27e8e00829ae4eb78310656d99dbaa37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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