Hydrochloric Acid → 2-[2-[3-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-3-oxopropyl]-5-methylphenoxy]-N-methylsulfonylacetamide

HRID 209776Notes

Reaction equation

HRID 209776 reaction equation
[CH2:57]([Cl:58])[Cl:59].[CH3:34][N:35]([CH3:36])[CH2:37][CH2:38][CH2:39][N:40]=[C:41]=[N:42][CH2:43][CH3:44].[CH3:45][S:46](=[O:47])(=[O:48])[NH2:49].[CH3:50][CH2:51][N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[CH3:60][N:61]([CH3:62])[c:63]1[cH:64][cH:65][n:66][cH:67][cH:68]1.[ClH:33].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[CH2:8][CH:9]([CH3:30])[N:10]([C:14]([CH2:15][CH2:16][c:17]3[c:18]([O:19][CH2:20][C:21](=[O:22])[OH:23])[cH:24][c:25]([CH3:28])[cH:26][cH:27]3)=[O:29])[CH2:11][CH:12]2[CH3:13])[cH:31][cH:32]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[CH2:8][CH:9]([CH3:30])[N:10]([C:14]([CH2:15][CH2:16][c:17]3[c:18]([O:19][CH2:20][C:21](=[O:22])[NH:49][S:46]([CH3:45])(=[O:47])=[O:48])[cH:24][c:25]([CH3:28])[cH:26][cH:27]3)=[O:29])[CH2:11][CH:12]2[CH3:13])[cH:31][cH:32]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 142844-(Dimethylamino)pyridineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 72879MethanesulfonamideHCID 103660712-[2-[3-[4-[(4-Fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-3-oxopropyl]-5-methylphenoxy]acetic acid

Product 1

HCID 101187882-[2-[3-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-3-oxopropyl]-5-methylphenoxy]-N-methylsulfonylacetamide

Sources & evidence

ORD record
ord-917aacc6a72f4f5caf420f36cdd3215d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…