Hydrochloric Acid → HCID 178458002, compound

HRID 664628Notes

Reaction equation

HRID 664628 reaction equation
[C:54]([CH3:55])([CH3:56])([CH3:57])[O:58][C:59]([CH:60]([NH2:61])[CH3:62])=[O:63].[CH3:65][N:66]1[CH2:67][CH2:68][O:69][CH2:70][CH2:71]1.[CH:39]1([N:40]=[C:41]=[N:42][CH:43]2[CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]2)[CH2:49][CH2:50][CH2:51][CH2:52][CH2:53]1.[Cl:72][CH2:73][Cl:74].[ClH:64].[F:1][CH:2]([CH2:3][CH2:4][CH:5]([C:6](=[O:7])[OH:8])[NH:9][C:10](=[O:11])[O:12][C:13]([CH3:14])([CH3:15])[CH3:16])[CH:17]([CH:18]=[CH2:19])[NH:20][C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27].[OH2:28].[OH:29][n:30]1[c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]2[n:37][n:38]1>>[F:1][CH:2]([CH2:3][CH2:4][CH:5]([C:6](=[O:8])[NH:61][CH:60]([C:59]([O:58][C:54]([CH3:55])([CH3:56])[CH3:57])=[O:63])[CH3:62])[NH:9][C:10](=[O:11])[O:12][C:13]([CH3:14])([CH3:15])[CH3:16])[CH:17]([CH:18]=[CH2:19])[NH:20][C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 962WaterHCID 6344DichloromethaneHCID 79724-MethylmorpholineHCID 10868DicyclohexylcarbodiimideHCID 757711-HydroxybenzotriazoleHCID 4351123Tert-butyl 2-aminopropanoateHCID 53927078HCID 53927078, compound

Product 1

HCID 178458002HCID 178458002, compound

Sources & evidence

ORD record
ord-43bfecbcd5ac44cdad7b3e77c488308f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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