Isoxazole, 4-(chloromethyl)-3,5-dimethyl- → HCID 11583888, compound

HRID 1013214Notes

Reaction equation

HRID 1013214 reaction equation
[F:1][C:2]1[CH:26]=[CH:25][C:5]2[CH:6]([C:11]3[C:19]4[C:14](=[CH:15][CH:16]=[CH:17][CH:18]=4)[N:13]([CH2:20][C:21]([OH:23])=[O:22])[C:12]=3[CH3:24])[NH:7][S:8](=[O:10])(=[O:9])[C:4]=2[CH:3]=1.Cl[CH2:28][C:29]1[C:30]([CH3:35])=[N:31][O:32][C:33]=1[CH3:34]>>[CH3:35][C:30]1[C:29]([CH2:28][N:7]2[CH:6]([C:11]3[C:19]4[C:14](=[CH:15][CH:16]=[CH:17][CH:18]=4)[N:13]([CH2:20][C:21]([OH:23])=[O:22])[C:12]=3[CH3:24])[C:5]3[CH:25]=[CH:26][C:2]([F:1])=[CH:3][C:4]=3[S:8]2(=[O:10])=[O:9])=[C:33]([CH3:34])[O:32][N:31]=1

Participants

3

Reactant 2

HCID 88246Isoxazole, 4-(chloromethyl)-3,5-dimethyl-HCID 59753847HCID 59753847, compound

Product 1

HCID 11583888HCID 11583888, compound

Procedure

The title compound was prepared by the method described for example 14 using the product from example 13, step e) and chloromethyl-3,5-dimethyl-isoxazole. 1H NMR (DMSO-d6) δ 13.1 (bs, 1H), 7-99 (dd, J=2.4, 7.5 Hz, 1H), 7.47 (dt, J=2.1, 8.8 Hz, 1H), 7.14-6.74 (m, 4H), 5.93 (s, 1H), 5.01 (s, 2H), 4.02 (d, J=15 Hz, 1H), 3.98 (d, 1H, J=15 Hz, 1H), 2.40 (s, 3H), 2.04 (s, 3H), 1.71 (s, 3H); MS: ESI (negative): 482 (M−H).

Sources & evidence

ORD record
ord-0143eb0188a343b6ad0a85162ed5b0be
Source dataset
uspto-grants-2011_07
Patent number
US07981912B2

Reaction notes

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