uspto-grants-2014_12 · 10.6084/m9.figshare.5104873.v1 · US08901156B2
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HCID69950125
N-((4-(4-Phenyithiazol-2-yl)tetrahydro-2H-pyran-4-yl)methyl)-5-(5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl)thiophene-2-carboxamide
N-[[4-(4-phenyl-1,3-thiazol-2-yl)oxan-4-yl]methyl]-5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophene-2-carboxamide
C23H19F3N4O3S2520.6 g/mol
IDENTITY
结构与身份
- 标准SMILES
- O=C(NCC1(c2nc(-c3ccccc3)cs2)CCOCC1)c1ccc(-c2noc(C(F)(F)F)n2)s1
- InChIKey
- OYSOUNVSIIPFGQ-UHFFFAOYSA-N
- 分子式
- C23H19F3N4O3S2
- 平均分子量
- 520.6 g/mol
- 单同位素质量
- 520.08506731
COMPUTED
结构计算性质
- XLogP
- 4.9
- 极性表面积
- 147 Ų
- 氢键供体
- 1
- 氢键受体
- 11
- 可旋转键
- 6
- 重原子
- 35
- 形式电荷
- 0
- 复杂度
- 737
ALIASES
名称与别名
N-((4-(4-Phenyithiazol-2-yl)tetrahydro-2H-pyran-4-yl)methyl)-5-(5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl)thiophene-2-carboxamideSCHEMBL6976778N-((4-(4-Phenylthiazol-2-yl)tetrahydro-2H-pyran-4-yl)methyl)-5-(5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl)thiophene-2-carboxamide
REACTIONS
参与反应