Propan-2-one--dichloromethane (1/1) → HCID 58659368, compound

HRID 1993512Notes

Reaction equation

HRID 1993512 reaction equation
CNS(CC1C=CC(NC2[CH:19]=[C:18]([O:20][C:21]3[CH:26]=[CH:25][C:24]([NH:27][C:28]([NH:30][C:31]4[CH:36]=[CH:35][C:34](N5CCOCC5)=[C:33]([C:43]([F:46])([F:45])[F:44])[CH:32]=4)=[O:29])=[CH:23][CH:22]=3)[N:17]=[CH:16][N:15]=2)=CC=1)(=O)=O.[CH2:47]([Cl:49])Cl.[CH3:50]C(C)=O>>[Cl:49][C:47]1[N:15]=[CH:16][N:17]=[C:18]([O:20][C:21]2[CH:22]=[CH:23][C:24]([NH:27][C:28]([NH:30][C:31]3[CH:36]=[CH:35][C:34]([CH3:50])=[C:33]([C:43]([F:45])([F:44])[F:46])[CH:32]=3)=[O:29])=[CH:25][CH:26]=2)[CH:19]=1

Participants

3

Reactant 2

HCID 21584124Propan-2-one--dichloromethane (1/1)HCID 58659357HCID 58659357, compound

Product 1

HCID 58659368HCID 58659368, compound

Procedure

The title compound is synthesized in analogy to the preparation of compound of Example 48 starting from compound of Stage 56.1: M+H=423.1/M+18=440.1; Rf (CH2Cl2/acetone=9:1): 0.42; 1H-NMR (400 MHz, DMSO-d6): 8.93/8.80 (s/s, 2H, urea), 7.91 (d, 2 Hz, 1H, pyrimidinyl), 7.51 (d, 9.5 Hz, 2H, phenyl), 7.47 (d, 8.0 Hz, 1H, phenyl-CF3), 7.29 (d, 8 Hz, 1H, phenyl-CF3), 7.27 (s, 1H, phenyl-CF3), 7.13 (d, 9.5 Hz, 2H, phenyl), 4.08 (m, 1H, pyrimidinyl), 2.63 (s/broad, 3H, CH3); m.p.=183.0-184.5° C.

Sources & evidence

ORD record
ord-cef80a2bada84349a4c33cf5965b059a
Source dataset
uspto-grants-2010_01
Patent number
US07652022B2

Reaction notes

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