thiazole RTI-219 → HCID 69274040, compound

HRID 49564Notes

Reaction equation

HRID 49564 reaction equation
S1C=CN=C1.[CH3:6][N:7]1[C@H:11]2[C@@H:12]([C:22]3[S:26][C:25]([C:27]4[CH:28]=[CH:29][CH:30]=[CH:31][CH:32]=4)=[CH:24][N:23]=3)[C@@H:13]([C:15]3[CH:16]=[CH:17][C:18]([Cl:21])=[CH:19][CH:20]=3)[CH2:14][C@@H:8]1[CH2:9][CH2:10]2>CO>[ClH:21].[Cl:21][C:18]1[CH:17]=[CH:16][C:15]([C@H:13]2[CH2:14][C@H:8]3[N:7]([CH3:6])[C@H:11]([CH2:10][CH2:9]3)[C@H:12]2[C:22]2[S:26][C:25]([C:27]3[CH:32]=[CH:31][CH:30]=[CH:29][CH:28]=3)=[CH:24][N:23]=2)=[CH:20][CH:19]=1

Participants

3

Reactant 1

HCID 86587253thiazole RTI-219

Product 1

HCID 69274040HCID 69274040, compound

Reagents, catalysts & solvents 1

HCID 887MethanolSolvent

Procedure

The thiazole was converted into hydrochloride salt: 1H NMR (MeOD) 1.99 (m, 1H), 2.51 (m, 5H), 2.93 (s, 3H), 3.79 (m, 2 H), 4.15 (m, 1H), 4.28 (m, 1H), 7.02 (d, J=8.5 Hz, 2H) 7.21 (d, J=8.5 Hz, 2H), 7.39 (m, 5H), 8.06 (s, 1H); mp 228-230° C.; Anal calcd for C23H24CIN2S.H2O; C=61.47, H=5.83, N=6.23, S=7.13, Cl=15.78; found C=61.61, H=5.76, N=6.20, S=7.51, Cl=15.84; [α]D+27.43° (c=0.11, CH3OH)

Sources & evidence

ORD record
ord-1db6a852ee124d41bdfef8f19c0efa39
Source dataset
uspto-grants-2004_03
Patent number
US06706880B2

Reaction notes

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