Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- Cn1c(COc2ccc(C=C3SC(=O)NC3=O)cc2)nc2cccnc21
- InChIKey
- UQXRFIYVBYAYDQ-UHFFFAOYSA-N
- 分子式
- C18H14N4O3S
- 平均分子量
- 366.4 g/mol
- 单同位素质量
- 366.07866149
COMPUTED
结构计算性质
- XLogP
- 2.5
- 极性表面积
- 111 Ų
- 氢键供体
- 1
- 氢键受体
- 6
- 可旋转键
- 4
- 重原子
- 26
- 形式电荷
- 0
- 复杂度
- 591
物化、安全与法规信息正在同步。
ALIASES
名称与别名
SCHEMBL7835286UQXRFIYVBYAYDQ-UHFFFAOYSA-N5-{4-(3-Methyl-3H-imidazo[4,5-b]pyridin-2-ylmethoxy)-benzylidene}thiazolidine-2,4-dione5-{4-(3-Methylimidazo[5,4-b]-pyridin-2-ylmethoxy)-benzylidene}thiazolidine-2,4-dione5-{4-(3-Methylimidazo[5,4-b]pyridin-2-ylmethoxy)-benzylidene}thiazolidine-2,4-dione5-{4-(3-Methylimidazo[5,4-b]pyridin-2-ylmethoxy)benzylidene}thiazolidine-2,4-dione
REACTIONS
参与反应
uspto-grants-1998_11 · 10.6084/m9.figshare.5104873.v1 · US05834501
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查看uspto-grants-1999_11 · 10.6084/m9.figshare.5104873.v1 · US05977365
查看uspto-grants-1999_10 · 10.6084/m9.figshare.5104873.v1 · US05962470
查看uspto-grants-2000_09 · 10.6084/m9.figshare.5104873.v1 · US06117893
查看Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D
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