Hydrochloric Acid → Hydrochloric Acid

HRID 200437Notes

Reaction equation

HRID 200437 reaction equation
[CH2:46]1[O:47][CH2:48][CH2:49][O:50][CH2:51]1.[CH3:1][C:2]([CH3:3])([c:4]1[cH:5][cH:6][c:7](-[c:10]2[c:11](-[c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[n:12][c:13]3[n:14]2-[c:15]2[c:16]([n:24][cH:25][cH:26][cH:27]2)[NH:17][c:18]2[c:19]-3[cH:20][cH:21][cH:22][cH:23]2)[cH:8][cH:9]1)[NH:34][C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41].[Cl:43][CH2:44][Cl:45].[ClH:42]>>[CH3:1][C:2]([CH3:3])([c:4]1[cH:5][cH:6][c:7](-[c:10]2[c:11](-[c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[n:12][c:13]3[n:14]2-[c:15]2[c:16]([n:24][cH:25][cH:26][cH:27]2)[NH:17][c:18]2[c:19]-3[cH:20][cH:21][cH:22][cH:23]2)[cH:8][cH:9]1)[NH2:34].[ClH:42]

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 312751,4-DioxaneHCID 69087668tert-butyl {1-methyl-1-[4-(2-phenyl-9H-imidazo[1,2-d]pyrido[2,3-b][1,4]benzodiazepin-3-yl) phenyl]ethyl}carbamate

Product 2

HCID 313Hydrochloric AcidHCID 56968963HCID 56968963, compound

Sources & evidence

ORD record
ord-722f1f5179e04291bfc0b35aa98fd504
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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