HCID86623527

(S)-1-(4-((2-chloro-4-morpholinothieno[3,2-d]pyrimidin-6-yl)methyl)piperazin-1-yl)-2-hydroxypropan-1-one

(2S)-1-[4-[(2-chloro-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl)methyl]piperazin-1-yl]-2-hydroxypropan-1-one

C18H24ClN5O3S425.9 g/mol

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IDENTITY

结构与身份

标准SMILES: C[C@H](O)C(=O)N1CCN(Cc2cc3nc(Cl)nc(N4CCOCC4)c3s2)CC1
InChIKey: DCRKUEFAUFQTAF-LBPRGKRZSA-N
分子式: C18H24ClN5O3S
平均分子量: 425.9 g/mol
单同位素质量: 425.1288385

COMPUTED

结构计算性质

已同步

XLogP: 1.2
极性表面积: 110 Å²
氢键供体: 1
氢键受体: 8
可旋转键: 4
重原子: 28
形式电荷: 0
复杂度: 547

ALIASES

名称与别名

共 5 条

SCHEMBL1181078DCRKUEFAUFQTAF-LBPRGKRZSA-N(S)-1-(4-((2-chloro-4 morpholinothieno[3,2-d]pyrimidin-6-yl)methyl)piperazin-1-yl)-2-hydroxypropan-1-one(S)-1-(4-((2-chloro-4-morpholinothieno[3,2-d]pyrimidin-6-yl)methyl)piperazin-1-yl)-2-hydroxypropan-1-one(S)-1-(4-((2-chloro-4morpholinothieno[3,2-d]pyrimidin-6-yl)methyl)piperazin-1-yl)-2-hydroxypropan-1-one

REACTIONS