Toluene → 5-(4-Chloro-phenyl)-1-phenyl-6-(4-pyridin-2-yl-phenyl)-1,5-dihydro-pyrazolo[3,4-d]pyrimidin-4-one

HRID 1541456Notes

Reaction equation

HRID 1541456 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9](-[c:24]3[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[c:10](=[O:23])[c:11]3[c:12]([n:13]2)[n:14](-[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[n:15][cH:16]3)[cH:6][cH:7]1.[CH2:31]([Sn:32]([CH2:33][CH2:34][CH2:35][CH3:42])([c:36]1[n:37][cH:38][cH:39][cH:40][cH:41]1)[CH2:43][CH2:44][CH2:45][CH3:46])[CH2:47][CH2:48][CH3:49].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[cH:57]1[cH:58][cH:59][c:60]([P:61]([Pd:62]([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([P:82]([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[P:101]([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)([c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[cH:132][cH:133]1>>[c:2]1(-[c:36]2[n:37][cH:38][cH:39][cH:40][cH:41]2)[cH:3][cH:4][c:5](-[c:8]2[n:9](-[c:24]3[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[c:10](=[O:23])[c:11]3[c:12]([n:13]2)[n:14](-[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[n:15][cH:16]3)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 6077842-(Tributylstannyl)pyridineHCID 20472026-(4-Bromophenyl)-5-(4-chlorophenyl)-1-phenyl-1H,4H,5H-pyrazolo[3,4-D]pyrimidin-4-oneHCID 178420554HCID 178420554, compound

Product 1

HCID 115185335-(4-Chloro-phenyl)-1-phenyl-6-(4-pyridin-2-yl-phenyl)-1,5-dihydro-pyrazolo[3,4-d]pyrimidin-4-one

Sources & evidence

ORD record
ord-e89155035f774aab95113e11792bf4ce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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