HCID178419240

5-Ethyl-2-fluoro-4-[3-(4,5,6,7-tetrahydro-1H-imidazol[4,5-c]pyridin-2-yl)-1H-indazol-6-yl]-phenol trihydrobromide salt

5-ethyl-2-fluoro-4-[3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-6-yl]phenol;trihydrobromide

C21H23Br3FN5O620.2 g/mol

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IDENTITY

结构与身份

标准SMILES: Br.Br.Br.CCc1cc(O)c(F)cc1-c1ccc2c(-c3nc4c([nH]3)CCNC4)n[nH]c2c1
InChIKey: UDWRHFLPIJUNHW-UHFFFAOYSA-N
分子式: C21H23Br3FN5O
平均分子量: 620.2 g/mol
单同位素质量: 616.94368

COMPUTED

结构计算性质

已同步

极性表面积: 89.6 Å²
氢键供体: 7
氢键受体: 5
可旋转键: 3
重原子: 31
形式电荷: 0
复杂度: 553

ALIASES

名称与别名

共 4 条

SCHEMBL14659046UDWRHFLPIJUNHW-UHFFFAOYSA-N5-ethyl-2-fluoro-4-[3-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-6-yl]-phenol trihydrobromide salt5-Ethyl-2-fluoro-4-[3-(4,5,6,7-tetrahydro-1H-imidazol[4,5-c]pyridin-2-yl)-1H-indazol-6-yl]-phenol trihydrobromide salt

REACTIONS