Trifluoroacetic acid → HCID 136340681, compound

HRID 2361176Notes

Reaction equation

HRID 2361176 reaction equation
[Br:1][C:2]1[CH:41]=[CH:40][CH:39]=[CH:38][C:3]=1[O:4][CH2:5][C@H:6]([OH:37])[CH2:7][NH:8][C:9]1[CH:14]=[CH:13][NH:12][C:11](=[O:15])[C:10]=1[C:16]1[NH:17][C:18]2[C:26]([N:27]=1)=[CH:25][C:24]1[C:23](=[O:28])[N:22]([CH:29]3[CH2:34][CH2:33][N:32]([CH2:35]C)[CH2:31][CH2:30]3)[CH2:21][C:20]=1[CH:19]=2.[C:42]([OH:48])([C:44]([F:47])([F:46])[F:45])=[O:43].Cl.Cl.ClC1C=CNC(=O)C=1C1NC2C(N=1)=CC1C(=O)N(C3CCN(CC)CC3)C(=O)C=1C=2.NC[C@@H](O)COC1C=CC=CC=1Br>>[F:45][C:44]([F:47])([F:46])[C:42]([OH:48])=[O:43].[Br:1][C:2]1[CH:41]=[C:40]([F:45])[CH:39]=[CH:38][C:3]=1[O:4][CH2:5][C@H:6]([OH:37])[CH2:7][NH:8][C:9]1[CH:14]=[CH:13][NH:12][C:11](=[O:15])[C:10]=1[C:16]1[NH:17][C:18]2[C:26]([N:27]=1)=[CH:25][C:24]1[C:23](=[O:28])[N:22]([CH:29]3[CH2:34][CH2:33][N:32]([CH3:35])[CH2:31][CH2:30]3)[CH2:21][C:20]=1[CH:19]=2

Participants

5

Reactant 4

HCID 6422Trifluoroacetic acidHCID 6543360HCID 6543360, compoundHCID 136200417HCID 136200417, compoundHCID 136340682HCID 136340682, compound

Product 1

HCID 136340681HCID 136340681, compound

Procedure

2-{4-[(R)-3-(2-bromo-phenoxy)-2-hydroxy-propylamino]-2-oxo-1,2-dihydro-pyridin-3-yl}-6-(1-ethyl-piperidin-4-yl)-6,7-dihydro-1H-1,3,6-triaza-s-indacen-5-one as TFA salt (5c) was prepared from 2-(4-chloro-2-oxo-1,2-dihydro-pyridin-3-yl)-6-(1-ethyl-piperidin-4-yl)-1H-1,3,6-triaza-s-indacene-5,7-dione dihydrochloride and (R)-1-amino-3-(2-bromo-phenoxy)-propan-2-ol. ESI-MS m/z 623.0 (M++2).

Sources & evidence

ORD record
ord-d2c07acbd9734eaa911bdd4624e0b375
Source dataset
uspto-grants-2014_04
Patent number
US08686005B2

Reaction notes

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