HCID178436918

{2-[6-(2-Ethyl-5-fluoro-4-hydroxy-phenyl)-1H-indazol-3-yl]-1,4,6,7-tetrahydro-imidazo[4,5-c]pyridin-5-yl}-isothiazol-3-yl-methanone

[2-[6-(2-ethyl-5-fluoro-4-hydroxyphenyl)-1H-indazol-3-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(1,2-thiazol-3-yl)methanone

C25H21FN6O2S488.5 g/mol

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IDENTITY

结构与身份

标准 SMILES: CCc1cc(O)c(F)cc1-c1ccc2c(-c3nc4c([nH]3)CCN(C(=O)c3ccsn3)C4)n[nH]c2c1
InChIKey: NZXZOMXHKCFGLS-UHFFFAOYSA-N
分子式: C25H21FN6O2S
平均分子量: 488.5 g/mol
单同位素质量: 488.14307327

COMPUTED

结构计算性质

已同步

XLogP: 4
极性表面积: 139 Å²
氢键供体: 3
氢键受体: 7
可旋转键: 4
重原子: 35
形式电荷: 0
复杂度: 780

ALIASES

名称与别名

共 4 条

CHEMBL3644619SCHEMBL14659118NZXZOMXHKCFGLS-UHFFFAOYSA-N{2-[6-(2-Ethyl-5-fluoro-4-hydroxy-phenyl)-1H-indazol-3-yl]-1,4,6,7-tetrahydro-imidazo[4,5-c]pyridin-5-yl}-isothiazol-3-yl-methanone

REACTIONS