Hydrochloric Acid → benzyl N-[5-[4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]-4-(cyclopentanecarbonylamino)-5-oxopentyl]carbamate

HRID 315625

Reaction equation

HRID 315625 reaction equation
[C:36](=[O:37])([Cl:38])[Cl:39].[CH2:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[CH:45]([N:46]([CH2:47][CH3:48])[CH:49]([CH3:50])[CH3:51])([CH3:52])[CH3:53].[Cl:54][CH2:55][Cl:56].[ClH:1].[NH2:2][CH:3]([CH2:4][CH2:5][CH2:6][NH:7][C:8]([O:9][CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)=[O:17])[C:18](=[O:19])[N:20]1[CH2:21][C:22]([CH3:34])([CH3:35])[C:23]([OH:26])([c:27]2[cH:28][cH:29][c:30]([Cl:33])[cH:31][cH:32]2)[CH2:24][CH2:25]1>>[NH:2]([CH:3]([CH2:4][CH2:5][CH2:6][NH:7][C:8]([O:9][CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)=[O:17])[C:18](=[O:19])[N:20]1[CH2:21][C:22]([CH3:34])([CH3:35])[C:23]([OH:26])([c:27]2[cH:28][cH:29][c:30]([Cl:33])[cH:31][cH:32]2)[CH2:24][CH2:25]1)[C:36](=[O:37])[CH:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 6371PhosgeneHCID 9253CyclopentaneHCID 81531DiisopropylethylamineHCID 178428668benzyl N-[4-amino-5-[4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]-5-oxopentyl]carbamate

Product 1

HCID 178428656benzyl N-[5-[4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]-4-(cyclopentanecarbonylamino)-5-oxopentyl]carbamate

Sources & evidence

ORD record
ord-3635de0399df4bfbb92c8565fecf06be
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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