Acetic Acid → N-(2,3-dihydro(1,4)dioxino(2,3-c)pyridin-7-ylmethyl)-2,2,2-trifluoro-N-(1-(2-(7-fluoro-2-oxo-1,5-naphthyridin-1(2H)-yl)ethyl)piperidin-3-ylmethyl)acetamide

HRID 2318289Notes

Reaction equation

HRID 2318289 reaction equation
[C:41]([O:42][BH-:43]([O:44][C:45](=[O:46])[CH3:47])[O:48][C:49](=[O:50])[CH3:51])(=[O:52])[CH3:53].[C:55](=[O:56])([O-:57])[OH:58].[CH3:67][C:68](=[O:69])[OH:70].[CH:63]([Cl:64])([Cl:65])[Cl:66].[Cl:60][CH2:61][Cl:62].[F:26][c:27]1[cH:28][n:29][c:30]2[cH:31][cH:32][c:33](=[O:40])[n:34]([CH2:37][CH:38]=[O:39])[c:35]2[cH:36]1.[Na+:54].[Na+:59].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[cH:6][n:7][c:8]([CH2:11][N:12]([C:13]([C:14]([F:15])([F:16])[F:17])=[O:18])[CH2:19][CH:20]3[CH2:21][NH:22][CH2:23][CH2:24][CH2:25]3)[cH:9][c:10]21>>[O:1]1[CH2:2][CH2:3][O:4][c:5]2[cH:6][n:7][c:8]([CH2:11][N:12]([C:13]([C:14]([F:15])([F:16])[F:17])=[O:18])[CH2:19][CH:20]3[CH2:21][N:22]([CH2:38][CH2:37][n:34]4[c:33](=[O:40])[cH:32][cH:31][c:30]5[n:29][cH:28][c:27]([F:26])[cH:36][c:35]54)[CH2:23][CH2:24][CH2:25]3)[cH:9][c:10]21

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 6212ChloroformHCID 6344DichloromethaneHCID 2724942TriacetoxyborohydrideHCID 578152751,5-Naphthyridine-1(2H)-acetaldehyde, 7-fluoro-2-oxo-HCID 57815464N-(2,3-dihydro(1,4)dioxino(2,3-c)pyridin-7-ylmethyl)-2,2,2-trifluoro-N-(piperidin-3-ylmethyl)acetamide

Product 1

HCID 57815282N-(2,3-dihydro(1,4)dioxino(2,3-c)pyridin-7-ylmethyl)-2,2,2-trifluoro-N-(1-(2-(7-fluoro-2-oxo-1,5-naphthyridin-1(2H)-yl)ethyl)piperidin-3-ylmethyl)acetamide

Sources & evidence

ORD record
ord-deade58424ab4bac89ab7b9be879f47a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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