Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- Nc1nc(N)c2c(OCC3CCNCC3)cccc2n1
- InChIKey
- QCFDMNMKUJDLQR-UHFFFAOYSA-N
- 分子式
- C14H19N5O
- 平均分子量
- 273.33 g/mol
- 单同位素质量
- 273.15896025
COMPUTED
结构计算性质
- XLogP
- 1.1
- 极性表面积
- 99.1 Ų
- 氢键供体
- 3
- 氢键受体
- 6
- 可旋转键
- 3
- 重原子
- 20
- 形式电荷
- 0
- 复杂度
- 310
ALIASES
名称与别名
872179-87-85-(piperidin-4-ylmethoxy)quinazoline-2,4-diamine5-[(PIPERIDIN-4-YL)METHOXY]QUINAZOLINE-2,4-DIAMINESCHEMBL1155228QCFDMNMKUJDLQR-UHFFFAOYSA-NF96956
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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
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