Sodium ion → Ceralasertib (AZD6738)

HRID 695853Notes

Reaction equation

HRID 695853 reaction equation
[CH3:3][CH:4]1[CH2:5][O:6][CH2:7][CH2:8][N:9]1[c:10]1[n:11][c:12](-[c:23]2[c:24]3[c:25]([n:26][cH:27][cH:28]2)[n:29]([S:32]([c:33]2[cH:34][cH:35][c:36]([CH3:37])[cH:38][cH:39]2)(=[O:40])=[O:41])[cH:30][cH:31]3)[n:13][c:14]([C:16]2([S:19](=[O:20])(=[NH:21])[CH3:22])[CH2:17][CH2:18]2)[cH:15]1.[CH3:42][O:43][CH2:44][CH2:45][O:46][CH3:47].[Na+:2].[OH-:1].[OH2:48]>>[CH3:3][CH:4]1[CH2:5][O:6][CH2:7][CH2:8][N:9]1[c:10]1[n:11][c:12](-[c:23]2[c:24]3[c:25]([n:26][cH:27][cH:28]2)[nH:29][cH:30][cH:31]3)[n:13][c:14]([C:16]2([S:19](=[O:20])(=[NH:21])[CH3:22])[CH2:17][CH2:18]2)[cH:15]1

Participants

6

Reactant 5

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

Product 1

HCID 76189844Ceralasertib (AZD6738)

Sources & evidence

ORD record
ord-10322c2559f54045afa9427d4d39f986
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…