基本信息
- 标准SMILES
Fc1cnc(Cl)nc1Nc1ccc2c(c1)OCCO2- InChIKey
ASRXSKWXNLKLKX-UHFFFAOYSA-N- 分子式
- C12H9ClFN3O2
- 平均分子量
- 281.67 g/mol
名称与标识
- 首选名称
- 2-chloro-5-fluoro-N-(3,4-ethylenedioxyphenyl)-4-pyrimidineamine
- IUPAC
- 2-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoropyrimidin-4-amine
名称与别名
SCHEMBL654380ASRXSKWXNLKLKX-UHFFFAOYSA-NAKOS0176321312-chloro-5-fluoro-N-(3,4-ethylenedioxyphenyl)-4-pyrimidineamine2-chloro-5-fluoro-N4-(3,4-ethylenedioxyphenyl)-4-pyrimidineamine2-chloro-N 4-(3,4-ethylenedioxyphenyl)-5-fluoro-4-pyrimidineamine2-chloro-N-(3,4-ethylenedioxyphenyl)-5-fluoro-4-pyrimidineamine2-chloro-N4-(3,4-ethlenedioxyphenyl)-5-fluoro-4-pyrimidineamine2-chloro-N4-(3,4-ethylendioxyphenyl)-5-fluoro-4-pyrimidineamine2-chloro-N4-(3,4-ethylenedioxyphenyl)-5-fluoro-4-primidineamine2-chloro-N4-(3,4-ethylenedioxyphenyl)-5-fluoro-4-pyrimidine amine2-chloro-N4-(3,4-ethylenedioxyphenyl)-5-fluoro-4-pyrimidineamine
展开更多名称
N4-(3,4-Ethylenedioxyphenyl)-2-chloro-5-fluoro-4-pyrimidineamine
数据库标识
- PubChem CID
- 22060362
性质
结构计算性质
- XLogP
- 2.9
- 极性表面积
- 56.3 Ų
- 氢键供体
- 1
- 氢键受体
- 6
- 可旋转键
- 2
- 重原子
- 19
- 形式电荷
- 0
- 复杂度
- 313
相关反应
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