Benzene → 7-[2-(Pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-imidazo[1,2-a]pyridine

HRID 702209Notes

Reaction equation

[C:28](=[O:29])([OH:30])[O-:31].[CH2:33]([Cl:34])[Cl:35].[CH3:42][CH2:43][OH:44].[Cl:1][c:2]1[cH:3][c:4]2[n:5]([cH:6][cH:7]1)[cH:8][cH:9][n:10]2.[Na+:32].[OH2:122].[cH:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[cH:45]1[cH:46][cH:47][c:48]([P:49]([Pd:50]([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[cH:120][cH:121]1.[n:11]1[c:12](-[c:17]2[c:18]([B:25]([OH:26])[OH:27])[c:19]3[n:20]([n:21]2)[CH2:22][CH2:23][CH2:24]3)[cH:13][cH:14][cH:15][cH:16]1>>[c:2]1(-[c:18]2[c:17](-[c:12]3[n:11][cH:16][cH:15][cH:14][cH:13]3)[n:21][n:20]3[c:19]2[CH2:24][CH2:23][CH2:22]3)[cH:3][c:4]2[n:5]([cH:6][cH:7]1)[cH:8][cH:9][n:10]2

Participants

Reactant 9

HCID 241Benzene

HCID 702Ethanol

HCID 769Bicarbonate Ion

HCID 923Sodium ion

HCID 962Water

HCID 6344Dichloromethane

HCID 196959017-Chloroimidazo(1,2-a)pyridine

HCID 59710031(2-pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-3-boronic acid

HCID 178420554HCID 178420554, compound

Product 1

HCID 117796147-[2-(Pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-imidazo[1,2-a]pyridine

Sources & evidence

ORD record: ord-c30e1c5eefef42a3ac58fc099e27fd58
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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