uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07091214B2
查看IDENTITY
结构与身份
- 标准SMILES
- O=[N+]([O-])c1cnc2cc(-c3ccccc3)ccc2c1NCCOc1ccccc1
- InChIKey
- QMMSPQKBDZCPKV-UHFFFAOYSA-N
- 分子式
- C23H19N3O3
- 平均分子量
- 385.4 g/mol
- 单同位素质量
- 385.14264148
COMPUTED
结构计算性质
- XLogP
- 5.8
- 极性表面积
- 80 Ų
- 氢键供体
- 1
- 氢键受体
- 5
- 可旋转键
- 6
- 重原子
- 29
- 形式电荷
- 0
- 复杂度
- 514
ALIASES
名称与别名
SCHEMBL3872009QMMSPQKBDZCPKV-UHFFFAOYSA-N(3-nitro-7- phenylquinolin-4-yl)-(2-phenoxyethyl)amine(3-nitro-7-phenylquinolin-4-yl)-(2-phenoxyethyl)amine
REACTIONS
参与反应
uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07091214B2
查看Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看uspto-grants-2009_10 · 10.6084/m9.figshare.5104873.v1 · US07598382B2
查看uspto-grants-2009_10 · 10.6084/m9.figshare.5104873.v1 · US07598382B2
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