4-(Dimethylamino)-2-methoxybenzaldehyde → HCID 178493177, 화합물

HRID 591968

반응식

HRID 591968 반응식
[NH2:1][C:2]1[C:7]([NH2:8])=[C:6]([NH:9][C@@H:10]2[C@@H:15]3[CH2:16][C@@H:12]([CH:13]=[CH:14]3)[C@@H:11]2[C:17]([NH2:19])=[O:18])[C:5]([Br:20])=[CH:4][N:3]=1.[CH3:21][N:22]([CH3:33])[C:23]1[CH:30]=[CH:29][C:26]([CH:27]=O)=[C:25]([O:31][CH3:32])[CH:24]=1>>[Br:20][C:5]1[C:6]([NH:9][C@@H:10]2[C@@H:15]3[CH2:16][C@@H:12]([CH:13]=[CH:14]3)[C@@H:11]2[C:17]([NH2:19])=[O:18])=[C:7]2[N:8]=[C:27]([C:26]3[CH:29]=[CH:30][C:23]([N:22]([CH3:33])[CH3:21])=[CH:24][C:25]=3[O:31][CH3:32])[NH:1][C:2]2=[N:3][CH:4]=1

참가 물질

3

반응물 2

HCID 2913504-(Dimethylamino)-2-methoxybenzaldehydeHCID 117701905(1S,2S,3R,4R)-3-(2,3-Diamino-5-bromo-pyridin-4-ylamino)-bicyclo[2.2.1]hept-5-ene-2-carboxylic acid amide

생성물 1

HCID 178493177HCID 178493177, 화합물수율 43%

실험 절차

In a similar fashion to Compound LXXVI, (1S,2S,3R,4R)-3-(2,3-Diamino-5-bromo-pyridin-4-ylamino)-bicyclo[2.2.1]hept-5-ene-2-carboxylic acid amide (40.0 mg, 0.118 mmol) and 4-dimethylamino-2-methoxy-benzaldehyde (23.3 mg, 0.130 mmol) were reacted to produce 25 mg (43%) of the title compound. mp: 218-220° C., 1H NMR (300 MHz, DMSO-d6): 13.00 (s, 1H), 8.24 (s, 1H), 8.00 (s, 1H), 7.96 (s, 1H), 7.73 (s, 1H), 6.99 (d, J=8 Hz, 2H), 6.43 (br s, 1H), 6.33 (br s, 1H), 5.16 (t, J=8 Hz, 1H), 3.94 (s, 3H), 2.87 (s, 1H), 2.73 (s, 1H), 2.59 (d, J=7 Hz, 1H), 2.23 (d, J=8 Hz, 1H), 1.90 (s, 1H), 1.37 (d, J=8 Hz, 1H). MS: 497, 499 (M+H), HPLC: 2.65 min (G method).

출처 및 근거

ORD 기록
ord-cc6d2e20de304c5faf2bfa4c6935a1e9
출처 데이터셋
uspto-grants-2016_01
특허 번호
US09238656B2

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