5-Amino-2-(trifluoromethyl)benzimidazole → HCID 66712435、化合物

HRID 1262370

反応式

HRID 1262370 の反応式
CS([C:4]1[N:9]=[CH:8][C:7]2=[CH:10][CH:11]=[C:12]([C:13]3[CH:14]=[N:15][C:16]([O:19][CH3:20])=[CH:17][CH:18]=3)[N:6]2[N:5]=1)=O.[F:21][C:22]([F:34])([F:33])[C:23]1[NH:24][C:25]2[CH:31]=[C:30]([NH2:32])[CH:29]=[CH:28][C:26]=2[N:27]=1>>[CH3:20][O:19][C:16]1[N:15]=[CH:14][C:13]([C:12]2[N:6]3[C:7]([CH:8]=[N:9][C:4]([NH:32][C:30]4[CH:29]=[CH:28][C:26]5[N:27]=[C:23]([C:22]([F:34])([F:33])[F:21])[NH:24][C:25]=5[CH:31]=4)=[N:5]3)=[CH:10][CH:11]=2)=[CH:18][CH:17]=1

参加物

3

反応物 2

HCID 193455-Amino-2-(trifluoromethyl)benzimidazoleHCID 66710847HCID 66710847、化合物

生成物 1

HCID 66712435HCID 66712435、化合物

実験手順

Following the synthetic and purification procedures described in Example 1293d, 2-methanesulfinyl-7-(6-methoxy-pyridin-3-yl)-pyrrolo[2,1-f][1,2,4]triazine (60 mg, 0.2 mmol) was coupled to 2-trifluoromethyl-3H-benzimidazol-5-ylamine (72 mg, 0.36 mmol) at 105° C. for 86 h to afford the title compound. Yield of TFA salt: 32 mg (30%) of tan powder; LC/MS: 426 (M+H); HPLC: 97% pure, RT=3.06 min; 1H NMR: (DMSO, δ) 9.64 (s, 1H), 9.02 (s, 1H), 8.97 (d, J=2.0, 1H), 8.56 (dd, J=8.8, 2.5, 1H), 8.12 (s, 1H), 7.66 (m, 2H), 7.22 (d, J=4.9, 1H), 7.01 (d, J=8.8, 1H), 6.99 (d, J=4.9, 1H), 3.94 (s, 3H)-benzimidazole NH presumably underwent rapid exchange with residual water.

後処理

  1. custompurification procedures

出典と根拠

ORDレコード
ord-eae2aca5708d4efd92a727064a5f1dd9
出典データセット
uspto-grants-2013_06
特許番号
US08471005B2

関連ノート

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