Hydrochloric Acid → 1-[[5-[2-(2,5-Difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]carbamoyl]cyclopropane-1-carboxylic acid

HRID 87344Notes

Reaction equation

HRID 87344 reaction equation
[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:42][OH:43].[ClH:36].[F:1][c:2]1[c:3]([CH:9]2[N:10]([c:14]3[n:15][c:16]4[n:17]([cH:18][cH:19]3)[n:20][cH:21][c:22]4[NH:23][C:24](=[O:25])[C:26]3([C:29](=[O:30])[O:31][CH3:32])[CH2:27][CH2:28]3)[CH2:11][CH2:12][CH2:13]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1.[Li+:35].[OH-:34].[OH2:33].[OH2:44].[OH2:45]>>[F:1][c:2]1[c:3]([CH:9]2[N:10]([c:14]3[n:15][c:16]4[n:17]([cH:18][cH:19]3)[n:20][cH:21][c:22]4[NH:23][C:24](=[O:25])[C:26]3([C:29](=[O:30])[OH:31])[CH2:27][CH2:28]3)[CH2:11][CH2:12][CH2:13]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 887MethanolHCID 961HydroxideHCID 962Water3×HCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 67330566Methyl 1-[[5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]carbamoyl]cyclopropane-1-carboxylate

Product 1

HCID 673305591-[[5-[2-(2,5-Difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]carbamoyl]cyclopropane-1-carboxylic acid

Sources & evidence

ORD record
ord-d856f5d53992471e9bc4066d8eedcf29
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…