HCID86669301

5,6 diamino-2-(2,2-difluoro-ethoxy)-N-(trans-4-trifluoromethyl-cyclohexyl)-nicotinamide

5,6-diamino-2-(2,2-difluoroethoxy)-N-[4-(trifluoromethyl)cyclohexyl]pyridine-3-carboxamide

C15H19F5N4O2382.33 g/mol

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IDENTITY

结构与身份

标准SMILES: Nc1cc(C(=O)NC2CCC(C(F)(F)F)CC2)c(OCC(F)F)nc1N
InChIKey: DIAZDHJEPBUOJD-UHFFFAOYSA-N
分子式: C15H19F5N4O2
平均分子量: 382.33 g/mol
单同位素质量: 382.14281667

COMPUTED

结构计算性质

已同步

XLogP: 2.9
极性表面积: 103 Å²
氢键供体: 3
氢键受体: 10
可旋转键: 5
重原子: 26
形式电荷: 0
复杂度: 471

ALIASES

名称与别名

共 6 条

5,6 diamino-2-(2,2-difluoro-ethoxy)-N-(trans-4-trifluoromethyl-cyclohexyl)-nicotinamideSCHEMBL672444SCHEMBL672445SCHEMBL10091441DIAZDHJEPBUOJD-UHFFFAOYSA-N5,6-Diamino-2-(2,2-difluoro-ethoxy)-N-(trans-4-trifluoromethyl-cyclohexyl)-nicotinamide

REACTIONS