Dichloromethane → HCID 59606046, compound

HRID 2136139Notes

Reaction equation

HRID 2136139 reaction equation
[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[Cl:73][CH2:74][Cl:75].[NH:1]1[CH2:2][CH:3]([CH2:5][c:6]2[n:7]([CH3:32])[c:8]3[n:9][c:10](-[n:21]4[c:22]([CH2:30][CH3:31])[n:23][c:24]5[c:25]4[cH:26][cH:27][cH:28][cH:29]5)[n:11][c:12]([N:15]4[CH2:16][CH2:17][O:18][CH2:19][CH2:20]4)[c:13]3[n:14]2)[CH2:4]1.[OH:33][C:34]([C:35](=[O:36])[OH:37])([CH3:38])[CH3:39].[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[n:66][cH:67][cH:68][cH:69][c:70]2[n:71][n:72]1>>[N:1]1([C:35]([C:34]([OH:33])([CH3:38])[CH3:39])=[O:36])[CH2:2][CH:3]([CH2:5][c:6]2[n:7]([CH3:32])[c:8]3[n:9][c:10](-[n:21]4[c:22]([CH2:30][CH3:31])[n:23][c:24]5[c:25]4[cH:26][cH:27][cH:28][cH:29]5)[n:11][c:12]([N:15]4[CH2:16][CH2:17][O:18][CH2:19][CH2:20]4)[c:13]3[n:14]2)[CH2:4]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 116712-Hydroxyisobutyric acidHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 596052818-Azetidin-3-ylmethyl-2-(2-ethylbenzoimidazol-1-yl)-9-methyl-6-morpholin-4-yl-9H-purine

Product 1

HCID 59606046HCID 59606046, compound

Sources & evidence

ORD record
ord-39c4d3a94c22453d9c9c8ab18d9951ea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…