Tetrafluoroborate → HCID 66760875, compound
Reaction equation
[B-:52]([F:53])([F:54])([F:55])[F:56].[Cl:74][c:75]1[c:76]([CH2:77][O:78][c:79]2[c:80]3[n:81][c:82]([O:83][CH3:84])[n:85]([CH2:86][c:87]4[cH:88][cH:89][cH:90][cH:91][n:92]4)[c:93]3[cH:94][cH:95][cH:96]2)[c:97]([Cl:98])[cH:99][cH:100][c:101]1[N:102]([CH3:103])[C:104](=[O:105])[CH2:106][NH:107][C:108](=[O:109])[CH2:110][CH2:111][c:112]1[cH:113][cH:114][c:115]([C:116]([NH:117][CH2:118][CH2:119][O:120][CH3:121])=[O:122])[cH:123][cH:124]1.[F:1][C:2]([C:3](=[O:4])[OH:5])([CH2:6][N:7]1[CH2:8][CH2:9][N:10]([C:13]([NH:14][CH3:15])=[O:16])[CH2:11][CH2:12]1)[F:17].[NH2:18][CH2:19][C:20](=[O:21])[N:22]([CH3:23])[c:24]1[c:25]([Cl:51])[c:26]([CH2:31][O:32][c:33]2[cH:34][cH:35][cH:36][c:37]3[n:38]([CH2:44][c:45]4[n:46][cH:47][cH:48][cH:49][cH:50]4)[c:39]([O:42][CH3:43])[n:40][c:41]23)[c:27]([Cl:30])[cH:28][cH:29]1.[n:57]1([O:58][C:59]([N:60]([CH3:61])[CH3:62])=[N+:63]([CH3:64])[CH3:65])[c:66]2[cH:67][cH:68][cH:69][cH:70][c:71]2[n:72][n:73]1>>[F:1][C:2]([C:3](=[O:5])[NH:18][CH2:19][C:20](=[O:21])[N:22]([CH3:23])[c:24]1[c:25]([Cl:51])[c:26]([CH2:31][O:32][c:33]2[cH:34][cH:35][cH:36][c:37]3[n:38]([CH2:44][c:45]4[n:46][cH:47][cH:48][cH:49][cH:50]4)[c:39]([O:42][CH3:43])[n:40][c:41]23)[c:27]([Cl:30])[cH:28][cH:29]1)([CH2:6][N:7]1[CH2:8][CH2:9][N:10]([C:13]([NH:14][CH3:15])=[O:16])[CH2:11][CH2:12]1)[F:17]Participants
6
Reactant 5
HCID 26255Tetrafluoroborate
HCID 130500O-benzotriazol-1-yl-tetramethyluronium
HCID 66760264HCID 66760264, compound
HCID 667603852-amino-N-(2,4-dichloro-3-(((2-methoxy-1-(pyridin-2-ylmethyl)-1H-benzo[d]imidazol-4-yl)oxy)methyl)phenyl)-N-methylacetamide
HCID 667609784-(3-((2-((2,4-dichloro-3-(((2-methoxy-1-(pyridin-2-ylmethyl)-1H-benzo[d]imidazol-4-yl)oxy)methyl)phenyl)(methyl)amino)-2-oxoethyl)amino)-3-oxopropyl)-N-(2-methoxyethyl)benzamideProduct 1
Sources & evidence
- ORD record
- ord-da0b984931054a2d9992e21fb8b2768c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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