Hydrochloric Acid → HCID 67265107, compound

HRID 702147Notes

Reaction equation

HRID 702147 reaction equation
[CH3:55][CH:56]([OH:57])[CH3:58].[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[Cl:28][c:29]1[c:30]2[c:31]([n:32][cH:33][n:34]1)[NH:35][C:36](=[O:45])[C:37]2=[CH:38][c:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1.[Cl:4][c:5]1[cH:6][c:7](-[c:12]2[n:13][c:14]([CH:22]3[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]3)[n:15]([CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[cH:16]2)[cH:8][cH:9][c:10]1[F:11].[ClH:1].[ClH:2].[ClH:3].[OH2:59]>>[Cl:4][c:5]1[cH:6][c:7](-[c:12]2[n:13][c:14]([CH:22]3[CH2:23][CH2:24][N:25]([c:29]4[c:30]5[c:31]([n:32][cH:33][n:34]4)[NH:35][C:36](=[O:45])[C:37]5=[CH:38][c:39]4[cH:40][cH:41][n:42][cH:43][cH:44]4)[CH2:26][CH2:27]3)[n:15]([CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[cH:16]2)[cH:8][cH:9][c:10]1[F:11]

Participants

7

Reactant 6

HCID 313Hydrochloric Acid3×HCID 962WaterHCID 3776IsopropanolHCID 81531DiisopropylethylamineHCID 67264737HCID 67264737, compoundHCID 86641619HCID 86641619, compound

Product 1

HCID 67265107HCID 67265107, compound

Sources & evidence

ORD record
ord-3ba3fafe661c4e85b7cbf5eb09056691
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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