Hydrochloric Acid → HCID 67177914, compound

HRID 140146Notes

Reaction equation

HRID 140146 reaction equation
[C:1](#[N:2])[CH2:3][C:4](=[O:5])[OH:6].[CH2:44]([CH3:45])[NH:46][C:47](=[O:48])[NH:49][c:50]1[cH:51][cH:52][c:53](-[c:56]2[n:57][c:58]([N:66]3[CH:67]([CH3:72])[CH2:68][O:69][CH2:70][CH2:71]3)[c:59]3[c:60]([n:61]2)[CH2:62][CH2:63][NH:64][CH2:65]3)[cH:54][cH:55]1.[CH3:23][N:24]([CH3:25])[CH2:26][CH2:27][CH2:28][N:29]=[C:30]=[N:31][CH2:32][CH3:33].[CH3:7][N:8]([CH3:9])[CH:10]=[O:11].[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[ClH:22].[ClH:43].[OH:12][n:13]1[c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]2[n:20][n:21]1>>[C:1](#[N:2])[CH2:3][C:4](=[O:6])[N:64]1[CH2:63][CH2:62][c:60]2[c:59]([c:58]([N:66]3[CH:67]([CH3:72])[CH2:68][O:69][CH2:70][CH2:71]3)[n:57][c:56](-[c:53]3[cH:52][cH:51][c:50]([NH:49][C:47]([NH:46][CH2:44][CH3:45])=[O:48])[cH:55][cH:54]3)[n:61]2)[CH2:65]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 9740Cyanoacetic acidHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 666884051-Ethyl-3-[4-[4-(3-methylmorpholin-4-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl]phenyl]urea

Product 1

HCID 67177914HCID 67177914, compound

Sources & evidence

ORD record
ord-9b7a9c0b2bba4888899d180b3ff99a64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…