HCID54480791

{3-[(Pyridine-3-sulfonylamino)-methyl]-phenyl}acetic acid methyl ester

methyl 2-[3-[(pyridin-3-ylsulfonylamino)methyl]phenyl]acetate

C15H16N2O4S320.4 g/mol

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: COC(=O)Cc1cccc(CNS(=O)(=O)c2cccnc2)c1
InChIKey: XOVYNPJYGLDTCF-UHFFFAOYSA-N
分子式: C15H16N2O4S
平均分子量: 320.4 g/mol
单同位素质量: 320.08307817

COMPUTED

结构计算性质

已同步

XLogP: 1.1
极性表面积: 93.7 Å²
氢键供体: 1
氢键受体: 6
可旋转键: 7
重原子: 22
形式电荷: 0
复杂度: 461

ALIASES

名称与别名

共 5 条

(3-((pyridine-3-sulfonylamino)-methyl)-phenyl)-acetic acid methyl ester{3-[(Pyridine-3-sulfonylamino)-methyl]-phenyl}-acetic acid methyl esterSCHEMBL5046938XOVYNPJYGLDTCF-UHFFFAOYSA-N{3-[(Pyridine-3-sulfonylamino)-methyl]-phenyl}acetic acid methyl ester

REACTIONS