uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08524738B2
查看IDENTITY
结构与身份
- 标准SMILES
- CC(C)(C)OC(=O)N(CC(=O)Nc1ccccn1)C1CCN(CCn2c(=O)cnc3ccccc32)CC1
- InChIKey
- JBSWLGACBSHCRY-UHFFFAOYSA-N
- 分子式
- C27H34N6O4
- 平均分子量
- 506.6 g/mol
- 单同位素质量
- 506.26415359
COMPUTED
结构计算性质
- XLogP
- 2.5
- 极性表面积
- 107 Ų
- 氢键供体
- 1
- 氢键受体
- 7
- 可旋转键
- 9
- 重原子
- 37
- 形式电荷
- 0
- 复杂度
- 835
物化、安全与法规信息正在同步。
ALIASES
名称与别名
SCHEMBL2796862JBSWLGACBSHCRY-UHFFFAOYSA-Ntert-butyl (2-oxo-2-(pyridin-2-ylamino)ethyl)(1-(2-(2-oxoquinoxalin-1(2H)-yl)ethyl)piperidin-4-yl)carbamatetert-butyl(2-oxo-2-(pyridin-2-ylamino)ethyl)(1-(2-(2-oxoquinoxalin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看uspto-grants-2012_12 · 10.6084/m9.figshare.5104873.v1 · US08329694B2
查看uspto-grants-2012_12 · 10.6084/m9.figshare.5104873.v1 · US08329694B2
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