Hydrochloric Acid → 4-(5-(1-oxoisoindolin-5-yl)imidazo[1,2-a]pyridin-8-ylamino)-N-(pyrrolidin-3-yl)benzene sulfonamide

HRID 698249Notes

Reaction equation

HRID 698249 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH:10]([NH:13][S:14](=[O:15])(=[O:16])[c:17]2[cH:18][cH:19][c:20]([NH:23][c:24]3[c:25]4[n:26]([c:27](-[c:30]5[cH:31][c:32]6[c:36]([cH:37][cH:38]5)[C:35](=[O:39])[NH:34][CH2:33]6)[cH:28][cH:29]3)[cH:40][cH:41][n:42]4)[cH:21][cH:22]2)[CH2:11][CH2:12]1)([CH3:5])([CH3:6])[CH3:7].[Cl:43][c:44]1[n:45]2[cH:46][cH:47][n:48][c:49]2[c:50]([NH:51][c:52]2[cH:53][cH:54][c:55]([N:56]3[CH2:57][CH2:58][N:59]([CH:60]([CH3:61])[CH3:62])[CH2:63][CH2:64]3)[cH:65][cH:66]2)[cH:67][cH:68]1.[ClH:69].[O:70]1[CH2:71][CH2:72][O:73][CH2:74][CH2:75]1>>[NH:8]1[CH2:9][CH:10]([NH:13][S:14](=[O:15])(=[O:16])[c:17]2[cH:18][cH:19][c:20]([NH:23][c:24]3[c:25]4[n:26]([c:27](-[c:30]5[cH:31][c:32]6[c:36]([cH:37][cH:38]5)[C:35](=[O:39])[NH:34][CH2:33]6)[cH:28][cH:29]3)[cH:40][cH:41][n:42]4)[cH:21][cH:22]2)[CH2:11][CH2:12]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 57580808(5-Chloro-imidazo[1,2-a]pyridin-8-yl)-[4-(4-isopropyl-piperazin-1-yl)-phenyl]-amineHCID 671207883-{4-[5-(1-Oxo-2,3-dihydro-1H-isoindol-5-yl)-imidazo[1,2-a]pyridin-8-ylamino]-benzenesulfonylamino}-pyrrolidine-1-carboxylic acid tert-butyl ester

Product 1

HCID 249888924-(5-(1-oxoisoindolin-5-yl)imidazo[1,2-a]pyridin-8-ylamino)-N-(pyrrolidin-3-yl)benzene sulfonamide

Sources & evidence

ORD record
ord-7cfb6843eb104eaa804f3123a9d1faf7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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