Hydrochloric Acid → Ceralasertib (AZD6738)

HRID 2328671Notes

Reaction equation

HRID 2328671 reaction equation
[CH3:1][CH:2]1[CH2:3][O:4][CH2:5][CH2:6][N:7]1[c:8]1[n:9][c:10](-[c:21]2[c:22]3[c:23]([n:24][cH:25][cH:26]2)[n:27]([S:30]([c:31]2[cH:32][cH:33][c:34]([CH3:35])[cH:36][cH:37]2)(=[O:38])=[O:39])[cH:28][cH:29]3)[n:11][c:12]([C:14]2([S:17](=[O:18])(=[NH:19])[CH3:20])[CH2:15][CH2:16]2)[cH:13]1.[CH3:43][O:44][CH2:45][CH2:46][O:47][CH3:48].[ClH:42].[Na+:41].[OH-:40].[OH2:49]>>[CH3:1][CH:2]1[CH2:3][O:4][CH2:5][CH2:6][N:7]1[c:8]1[n:9][c:10](-[c:21]2[c:22]3[c:23]([n:24][cH:25][cH:26]2)[nH:27][cH:28][cH:29]3)[n:11][c:12]([C:14]2([S:17](=[O:18])(=[NH:19])[CH3:20])[CH2:15][CH2:16]2)[cH:13]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 80711,2-DimethoxyethaneHCID 178427326HCID 178427326, compound

Product 1

HCID 76189844Ceralasertib (AZD6738)

Sources & evidence

ORD record
ord-7967ad8c3beb439c99eb2788fdfd8713
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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