uspto-grants-1977_12 · 10.6084/m9.figshare.5104873.v1 · US04062682
查看IDENTITY
结构与身份
- 标准SMILES
- CCn1c(C)nc2cc(C(N)=O)ccc21
- InChIKey
- BDFKILCKIHZXQF-UHFFFAOYSA-N
- 分子式
- C11H13N3O
- 平均分子量
- 203.24 g/mol
- 单同位素质量
- 203.10586205
COMPUTED
结构计算性质
- XLogP
- 1
- 极性表面积
- 60.9 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 2
- 重原子
- 15
- 形式电荷
- 0
- 复杂度
- 256
ALIASES
名称与别名
MLS00075629062306-07-4DTXSID70303459RefChem:357103DTXCID50254591NSC1584101-ethyl-2-methyl-5-carbamyl-benzimidazoleCHEMBL1502160SCHEMBL18191353HMS2886P20NSC-158410SMR000528665N-Ethyl-2-methyl-5-benzimidazolecarboxamide1-Ethyl-2-methyl-1H-benzimidazole-5-carboxamide #1-Ethyl-2-methyl-1H-1,3-benzimidazole-5-carboxamide1-Ethyl-2-methyl-1H-benzo[d]imidazole-5-carboxamide
REACTIONS