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
- CON(C)C(=O)c1ccc(Oc2ccc(Cl)cc2N)cc1
- InChIKey
- KKHHKAVFNXPOTF-UHFFFAOYSA-N
- 分子式
- C15H15ClN2O3
- 平均分子量
- 306.74 g/mol
- 单同位素质量
- 306.07712
COMPUTED
结构计算性质
- XLogP
- 2.9
- 极性表面积
- 64.8 Ų
- 氢键供体
- 1
- 氢键受体
- 4
- 可旋转键
- 4
- 重原子
- 21
- 形式电荷
- 0
- 复杂度
- 348
ALIASES
名称与别名
SCHEMBL2961914KKHHKAVFNXPOTF-UHFFFAOYSA-N4-(2-amino-4-chlorophenoxy)-N-methoxy-N-methylbenzamide
REACTIONS
参与反应
uspto-grants-2012_12 · 10.6084/m9.figshare.5104873.v1 · US08338605B2
查看uspto-grants-2012_12 · 10.6084/m9.figshare.5104873.v1 · US08338605B2
查看uspto-grants-2012_12 · 10.6084/m9.figshare.5104873.v1 · US08338605B2
查看Training data from https://doi.org/10.1039/C8SC04228D (10/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (10/10) · 10.1039/C8SC04228D
查看uspto-grants-2010_07 · 10.6084/m9.figshare.5104873.v1 · US07763731B2
查看uspto-grants-2010_07 · 10.6084/m9.figshare.5104873.v1 · US07763731B2
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