HCID 86700216, 화합물 → HCID 86700403, 화합물
반응식
C(O[C@@H](C1C(C)=CC2N=C(C3C=CC4N(C)N=NC=4C=3)SC=2C=1C1C=CC(Cl)=CC=1)C(O)=O)(C)(C)C.[C:37]([O:41][C@@H:42]([C:48]1[C:67]([CH3:68])=[CH:66][C:51]2[N:52]=[C:53]([C:55]3[CH:60]=[CH:59][N:58]4[C:61]([CH3:65])=[N:62][C:63]([CH3:64])=[C:57]4[CH:56]=3)[S:54][C:50]=2[C:49]=1[C:69]1[CH:74]=[CH:73][C:72]([Cl:75])=[CH:71][CH:70]=1)[C:43]([O:45]CC)=[O:44])([CH3:40])([CH3:39])[CH3:38]>>[C:37]([O:41][C@@H:42]([C:48]1[C:67]([CH3:68])=[CH:66][C:51]2[N:52]=[C:53]([C:55]3[CH:60]=[CH:59][N:58]4[C:61]([CH3:65])=[N:62][C:63]([CH3:64])=[C:57]4[CH:56]=3)[S:54][C:50]=2[C:49]=1[C:69]1[CH:70]=[CH:71][C:72]([Cl:75])=[CH:73][CH:74]=1)[C:43]([OH:45])=[O:44])([CH3:40])([CH3:38])[CH3:39]참가 물질
3
실험 절차
Prepared in a manner similar to (S)-2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(1-methyl-1H-benzo[d][1,2,3]triazol-5-yl)benzo[d]thiazol-6-yl)acetic acid, but using (S)-ethyl 2-tert-butoxy-2-(7-(4-chlorophenyl)-2-(1,3-dimethylimidazo[1,5-a]pyridin-7-yl)-5-methylbenzo[d]thiazol-6-yl)acetate instead of (S)-ethyl 2-tert-butoxy-2-(7-(4-chlorophenyl)-5-methyl-2-(1-methyl-1H-benzo[d][1,2,3]triazol-5-yl)benzo[d]thiazol-6-yl)acetate. LCMS-ESI+: calc'd for C29H29ClN3O3S: 534.1 (M+H+); Found: 534.2 (M+H+). 1H NMR (400 MHz, CD3OD) δ 8.33 (s, 1H), 8.28 (d, J=7.7 Hz, 1H), 7.87 (s, 1H), 7.76-7.65 (m, 2H), 7.60 (d, J=6.4 Hz, 3H), 5.27 (s, 1H), 2.86 (s, 3H), 2.65 (s, 3H), 2.62 (s, 3H), 0.98 (s, 9H).
출처 및 근거
- ORD 기록
- ord-c63ba9a8d65f4d3bbbb92e35a306686f