HCID86623517

N-((2-chloro-4-morpholinothieno[2,3-d]pyrimidin-6-yl)methyl)-N,1-dimethylpiperidin-4-amine

N-[(2-chloro-4-morpholin-4-ylthieno[2,3-d]pyrimidin-6-yl)methyl]-N,1-dimethylpiperidin-4-amine

C18H26ClN5OS396 g/mol

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准 SMILES: CN1CCC(N(C)Cc2cc3c(N4CCOCC4)nc(Cl)nc3s2)CC1
InChIKey: GIWIFLNVUUMSPG-UHFFFAOYSA-N
分子式: C18H26ClN5OS
平均分子量: 396 g/mol
单同位素质量: 395.1546593

COMPUTED

结构计算性质

已同步

XLogP: 3.1
极性表面积: 73 Å²
氢键供体: 0
氢键受体: 7
可旋转键: 4
重原子: 26
形式电荷: 0
复杂度: 461

ALIASES

名称与别名

共 4 条

SCHEMBL1180779GIWIFLNVUUMSPG-UHFFFAOYSA-NN-((2-chloro-4-morpholinothieno[2,3-d]pyrimidin-6-yl)methyl)-N,1-dimethylpiperidin-4-amine(2-chloro-4-morpholin-4-yl-thieno[2,3-d]pyrimidin-6-ylmethyl)-methyl-(1-methyl-piperidin-4-yl)-amine

REACTIONS

参与反应

20 条

全部作为反应物作为生成物作为试剂作为催化剂作为溶剂

HRID94728

Training data from https://doi.org/10.1039/C8SC04228D (2/10)

作为反应物

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

查看条件与参与物

HRID284956

Training data from https://doi.org/10.1039/C8SC04228D (8/10)

作为生成物

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

查看条件与参与物

HRID390878

uspto-grants-2013_02

作为生成物