Hydrochloric Acid → HCID 178428909, compound

HRID 310486Notes

Reaction equation

HRID 310486 reaction equation
[C:20]([CH3:21])([CH3:22])([CH3:23])[O:24][C:25](=[O:26])[NH:27][CH2:28][CH:29]([C:30](=[O:31])[OH:32])[c:33]1[cH:34][cH:35][c:36]([Cl:39])[cH:37][cH:38]1.[CH3:3][CH:4]1[CH2:5][CH:6]([OH:19])[c:7]2[n:8][cH:9][n:10][c:11]([N:13]3[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]3)[c:12]21.[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[Cl:73][CH2:74][Cl:75].[ClH:1].[ClH:2].[P-:49]([F:50])([F:51])([F:52])([F:53])([F:54])[F:55].[n:56]1([O:57][C:58]([N:59]([CH3:60])[CH3:61])=[N+:62]([CH3:63])[CH3:64])[c:65]2[cH:66][cH:67][cH:68][cH:69][c:70]2[n:71][n:72]1>>[CH3:3][CH:4]1[CH2:5][CH:6]([OH:19])[c:7]2[n:8][cH:9][n:10][c:11]([N:13]3[CH2:14][CH2:15][N:16]([C:30]([CH:29]([CH2:28][NH:27][C:25]([O:24][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:26])[c:33]4[cH:34][cH:35][c:36]([Cl:39])[cH:37][cH:38]4)=[O:31])[CH2:17][CH2:18]3)[c:12]21

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 446078373-(((Tert-butoxy)carbonyl)amino)-2-(4-chlorophenyl)propanoic acidHCID 685203895-methyl-4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol

Product 1

HCID 178428909HCID 178428909, compound

Sources & evidence

ORD record
ord-2601a8b1267548cda82a8a1cbc7f91ec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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