Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- Cc1cc(Cl)nc(-c2ccccn2)n1
- InChIKey
- QXTIZJZQBKJJCB-UHFFFAOYSA-N
- 分子式
- C10H8ClN3
- 平均分子量
- 205.64 g/mol
- 单同位素质量
- 205.040675
COMPUTED
结构计算性质
- XLogP
- 2.2
- 极性表面积
- 38.7 Ų
- 氢键供体
- 0
- 氢键受体
- 3
- 可旋转键
- 1
- 重原子
- 14
- 形式电荷
- 0
- 复杂度
- 188
物化、安全与法规信息正在同步。
ALIASES
名称与别名
77168-31-14-chloro-6-methyl-2-(pyridin-2-yl)pyrimidineDTXSID40376933RefChem:291879DTXCID00327961816-917-14-chloro-6-methyl-2-(2-pyridinyl)pyrimidine4-chloro-6-methyl-2-pyridin-2-ylpyrimidineMFCD006627864-chloro-6-methyl-2-(2-pyridyl)pyrimidineSCHEMBL5480168QXTIZJZQBKJJCB-UHFFFAOYSA-NCDA16831SBB054535AKOS005069625CS-04555746-Chloro-4-methyl-2-(2-pyridinyl)pyrimidineEN300-695354-chloro-6-methyl -2-(2-pyridinyl)pyrimidine6-chloro-4-methyl-2-(pyridin-2-yl)pyrimidine
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 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 (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
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