HCID66687946

Methyl 4-{2-[(benzofuran-2-yl-carbonyl)amino]ethylsulfanyl}benzoate

methyl 4-[2-(1-benzofuran-2-carbonylamino)ethylsulfanyl]benzoate

C19H17NO4S355.4 g/mol

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IDENTITY

结构与身份

标准SMILES: COC(=O)c1ccc(SCCNC(=O)c2cc3ccccc3o2)cc1
InChIKey: HNWSDWJGIRPPHP-UHFFFAOYSA-N
分子式: C19H17NO4S
平均分子量: 355.4 g/mol
单同位素质量: 355.0878292

COMPUTED

结构计算性质

已同步

XLogP: 4
极性表面积: 93.8 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 7
重原子: 25
形式电荷: 0
复杂度: 464

ALIASES

名称与别名

共 8 条

methyl 4-{2-[(benzofuran-2-yl-carbonyl)-amino]ethylsulfanyl)benzoatemethyl 4-{2-[(benzofuran-2-yl-carbonyl)-amino]ethylsulfanyl}benzoateSCHEMBL443925HNWSDWJGIRPPHP-UHFFFAOYSA-Nmethyl 4-{2-[(benzofuran-2-yl-carbonyl)amino]ethylsulfanyl}benzoatemethyl 4-{2-[(benzofuran-2-ylcarbonyl)-amino]ethylsulfanyl}benzoatemethyl 4-{2-[(benzofuran-2-ylcarbonyl)amino]ethyl-sulfanyl}benzoatemethyl 4-{2-[(benzofuran-2-yl-carbonyl)amino]ethylsulfanyl}-benzoate

REACTIONS