HCID17973686

(RS)-1-[2-(1H-benzoimidazol-2-ylmethyl)-piperidin-1-yl]-1-[5-(4-fluoro phenyl)-2-methyl-thiazol-4-yl]-methanone

[2-(1H-benzimidazol-2-ylmethyl)piperidin-1-yl]-[5-(4-fluorophenyl)-2-methyl-1,3-thiazol-4-yl]methanone

C24H23FN4OS434.5 g/mol

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IDENTITY

结构与身份

标准SMILES: Cc1nc(C(=O)N2CCCCC2Cc2nc3ccccc3[nH]2)c(-c2ccc(F)cc2)s1
InChIKey: PCRKBVIJNZHKTM-UHFFFAOYSA-N
分子式: C24H23FN4OS
平均分子量: 434.5 g/mol
单同位素质量: 434.15766071

COMPUTED

结构计算性质

已同步

XLogP: 5.4
极性表面积: 90.1 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 4
重原子: 31
形式电荷: 0
复杂度: 631

ALIASES

名称与别名

共 4 条

SCHEMBL1256846PCRKBVIJNZHKTM-UHFFFAOYSA-N(RS)-1-[2-(1H-benzoimidazol-2-ylmethyl)-piperidin-1-yl]-1-[5-(4-fluoro phenyl)-2-methyl-thiazol-4-yl]-methanone(RS)-1-[2-(1H-benzoimidazol-2-ylmethyl)-piperidin-1-yl]-1-[5-(4-fluoro-phenyl)-2-methyl-thiazol-4-yl]-methanone

REACTIONS