Acetate → (4-Chloro-6-methoxy-quinolin-7-yl)-(2-morpholin-4-yl-ethyl)-amine

HRID 2330780Notes

Reaction equation

HRID 2330780 reaction equation
[C:77](=[O:78])([O-:79])[O-:80].[C:90]([O-:91])(=[O:92])[CH3:93].[C:95]([O-:96])(=[O:97])[CH3:98].[CH3:83][c:84]1[cH:85][cH:86][cH:87][cH:88][cH:89]1.[Cs+:81].[Cs+:82].[F:47][C:48]([F:49])([F:50])[S:51]([O:52][c:53]1[c:54]([O:64][CH3:65])[cH:55][c:56]2[c:57]([Cl:63])[cH:58][cH:59][n:60][c:61]2[cH:62]1)(=[O:66])=[O:67].[O:68]1[CH2:69][CH2:70][N:71]([CH2:74][CH2:75][NH2:76])[CH2:72][CH2:73]1.[OH2:99].[Pd+2:94].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][c:12]3[c:13]([cH:14][cH:15][cH:16][cH:17]3)[c:18]2-[c:19]2[c:20]3[c:21]([cH:22][cH:23][cH:24][cH:25]3)[cH:26][cH:27][c:28]2[P:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[c:53]1([NH:76][CH2:75][CH2:74][N:71]2[CH2:70][CH2:69][O:68][CH2:73][CH2:72]2)[c:54]([O:64][CH3:65])[cH:55][c:56]2[c:57]([Cl:63])[cH:58][cH:59][n:60][c:61]2[cH:62]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 962WaterHCID 1140TolueneHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 4082852-MorpholinoethylamineHCID 634876Binap, (A+-)-HCID 859455444-Chloro-6-methoxy-quinolin-7-yl trifluoro-methanesulfonate

Product 1

HCID 23078325(4-Chloro-6-methoxy-quinolin-7-yl)-(2-morpholin-4-yl-ethyl)-amine

Sources & evidence

ORD record
ord-82775e1f2d074e1fac46eea61f301344
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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