Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- COC(=O)c1cc(N)c2nc(C)c(C)n2c1
- InChIKey
- PMBNZGLPCRRWTP-UHFFFAOYSA-N
- 分子式
- C11H13N3O2
- 平均分子量
- 219.24 g/mol
- 单同位素质量
- 219.10077667
COMPUTED
结构计算性质
- XLogP
- 1.7
- 极性表面积
- 69.6 Ų
- 氢键供体
- 1
- 氢键受体
- 4
- 可旋转键
- 2
- 重原子
- 16
- 形式电荷
- 0
- 复杂度
- 284
ALIASES
名称与别名
248919-96-2methyl 8-amino-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylateMETHYL 8-AMINO-2,3-DIMETHYL-IMIDAZO[1,2-A]PYRIDINE-6-CARBOXYLATEMFCD24623056SCHEMBL4165967PMBNZGLPCRRWTP-UHFFFAOYSA-NDTXSID801175545SY286908DB-221218H35830methyl 8-amino-2,3-dimethylimidazo[1.2-a]pyridine-6-carboxylate
REACTIONS
相关反应
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