HCID2802901

5-(Benzyloxy)-2-(piperazin-1-yl)pyrimidine

5-phenylmethoxy-2-piperazin-1-ylpyrimidine

C15H18N4O270.33 g/molCAS 87789-61-5

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IDENTITY

结构与身份

标准SMILES: c1ccc(COc2cnc(N3CCNCC3)nc2)cc1
InChIKey: NGCDQKNRWBVNTI-UHFFFAOYSA-N
分子式: C15H18N4O
平均分子量: 270.33 g/mol
单同位素质量: 270.14806121

COMPUTED

结构计算性质

等待补全

XLogP: 1.5
极性表面积: 50.3 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 4
重原子: 20
形式电荷: 0
复杂度: 269

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 21 条

87789-61-55-(Benzyloxy)-2-(piperazin-1-yl)pyrimidineDTXSID50384382RefChem:300223DTXCID603354065-Benzyloxy-2-(1-piperazinyl)pyrimidine5-phenylmethoxy-2-piperazin-1-ylpyrimidine5-(Phenylmethoxy)-2-(1-piperazinyl)-pyrimidine;Maybridge2_000099SCHEMBL8106889NGCDQKNRWBVNTI-UHFFFAOYSA-NHMS1303E11CCG-472075-(benzyloxy)-2-piperazinopyrimidineAKOS016000805IDI1_001139AS-88383DB-3682625-Phenylmethoxy-2-(1-piperazinyl)pyrimidineH54969

REACTIONS

参与反应

3 条

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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

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uspto-grants-1983_12 · 10.6084/m9.figshare.5104873.v1 · US04423049

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