Hydrochloric Acid → Hydrochloric Acid

HRID 689104Notes

Reaction equation

HRID 689104 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH:8]([CH2:9][C:10](=[O:11])[N:12]1[CH2:13][c:14]2[n:15]([c:18]([C:28]([F:29])([F:30])[F:31])[n:19][c:20]2[C:21](=[O:22])[CH:23]2[CH2:24][CH2:25][CH2:26][CH2:27]2)[CH2:16][CH2:17]1)[CH2:32][c:33]1[c:34]([F:41])[cH:35][c:36]([F:40])[c:37]([F:39])[cH:38]1)([CH3:5])([CH3:6])[CH3:42].[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[ClH:43]>>[ClH:43].[NH2:7][CH:8]([CH2:9][C:10](=[O:11])[N:12]1[CH2:13][c:14]2[n:15]([c:18]([C:28]([F:29])([F:30])[F:31])[n:19][c:20]2[C:21](=[O:22])[CH:23]2[CH2:24][CH2:25][CH2:26][CH2:27]2)[CH2:16][CH2:17]1)[CH2:32][c:33]1[c:34]([F:41])[cH:35][c:36]([F:40])[c:37]([F:39])[cH:38]1

Participants

5

Reactant 3

HCID 313Hydrochloric AcidHCID 8857Ethyl AcetateHCID 76553210tert-butyl N-[4-[1-(cyclopentanecarbonyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-4-oxo-1-(2,4,5-trifluorophenyl)butan-2-yl]carbamate

Product 2

HCID 313Hydrochloric AcidHCID 749471663-amino-1-[1-(cyclopentanecarbonyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one

Sources & evidence

ORD record
ord-db06ba7a41f94e888ed897361f44f864
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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