Dichloromethane → a possible structure for AZD-6088

HRID 702741Notes

Reaction equation

HRID 702741 reaction equation
[CH3:1][C:2]1([N:8]2[CH2:9][CH2:10][CH:11]([N:14]3[C:15](=[O:23])[NH:16][CH:17]4[CH:18]3[CH2:19][CH2:20][CH2:21][CH2:22]4)[CH2:12][CH2:13]2)[CH2:3][CH2:4][NH:5][CH2:6][CH2:7]1.[CH:24]([N:25]([CH:26]([CH3:27])[CH3:28])[CH2:29][CH3:30])([CH3:31])[CH3:32].[Cl:33][C:34](=[O:35])[O:36][CH:37]([CH3:38])[CH3:39].[Cl:40][CH2:41][Cl:42]>>[CH3:1][C:2]1([N:8]2[CH2:9][CH2:10][CH:11]([N:14]3[C:15](=[O:23])[NH:16][CH:17]4[CH:18]3[CH2:19][CH2:20][CH2:21][CH2:22]4)[CH2:12][CH2:13]2)[CH2:3][CH2:4][N:5]([C:34](=[O:35])[O:36][CH:37]([CH3:38])[CH3:39])[CH2:6][CH2:7]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 7917Isopropyl chloroformateHCID 81531DiisopropylethylamineHCID 576198323-[1-(4-methylpiperidin-4-yl)piperidin-4-yl]-3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-one

Product 1

HCID 66757277a possible structure for AZD-6088

Sources & evidence

ORD record
ord-04013af13f9c4d2f9c698334f84e3a4d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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