Hydrochloric Acid → 1-[3-[[1-(4-Ethoxycarbonylpiperazin-1-yl)-5-[(2-methylpropan-2-yl)oxy]-1,5-dioxopentan-2-yl]carbamoyl]-1-phenylpyrazol-5-yl]oxycyclobutane-1-carboxylic acid

HRID 832370Notes

Reaction equation

HRID 832370 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12]([CH:13]([CH2:14][CH2:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[NH:23][C:24](=[O:25])[c:26]2[n:27][n:28](-[c:41]3[cH:42][cH:43][cH:44][cH:45][cH:46]3)[c:29]([O:31][C:32]3([C:36](=[O:37])[O:38][CH2:39][CH3:40])[CH2:33][CH2:34][CH2:35]3)[cH:30]2)=[O:47])[CH2:10][CH2:11]1.[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[ClH:50].[Na+:49].[OH-:48]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12]([CH:13]([CH2:14][CH2:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[NH:23][C:24](=[O:25])[c:26]2[n:27][n:28](-[c:41]3[cH:42][cH:43][cH:44][cH:45][cH:46]3)[c:29]([O:31][C:32]3([C:36](=[O:37])[OH:38])[CH2:33][CH2:34][CH2:35]3)[cH:30]2)=[O:47])[CH2:10][CH2:11]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 66920126Ethyl 4-[2-[[5-(1-ethoxycarbonylcyclobutyl)oxy-1-phenylpyrazole-3-carbonyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]piperazine-1-carboxylate

Product 1

HCID 669200501-[3-[[1-(4-Ethoxycarbonylpiperazin-1-yl)-5-[(2-methylpropan-2-yl)oxy]-1,5-dioxopentan-2-yl]carbamoyl]-1-phenylpyrazol-5-yl]oxycyclobutane-1-carboxylic acid

Sources & evidence

ORD record
ord-d1a16a1a27aa4880b1820dbb50ec9411
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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