HCID11633995

2-[({2-[3-(Diethylamino)propoxy]phenyl}sulfonyl)amino]-5,6,7,8-tetrahydro-1-naphthalenecarboxylic acid

2-[[2-[3-(diethylamino)propoxy]phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid

C24H32N2O5S460.6 g/mol

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IDENTITY

结构与身份

标准SMILES: CCN(CC)CCCOc1ccccc1S(=O)(=O)Nc1ccc2c(c1C(=O)O)CCCC2
InChIKey: QFEHYLCTLSRBTJ-UHFFFAOYSA-N
分子式: C24H32N2O5S
平均分子量: 460.6 g/mol
单同位素质量: 460.2031933

COMPUTED

结构计算性质

已同步

XLogP: 2.7
极性表面积: 104 Å²
氢键供体: 2
氢键受体: 7
可旋转键: 11
重原子: 32
形式电荷: 0
复杂度: 691

ALIASES

名称与别名

共 7 条

CHEMBL209368SCHEMBL3982222BDBM17550QFEHYLCTLSRBTJ-UHFFFAOYSA-NAnthranilic Acid Sulfonamide, 20a2-({2-[3-(diethylamino)propoxy]benzene}sulfonamido)-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid2-[({2-[3-(diethylamino)propoxy]phenyl}sulfonyl)amino]-5,6,7,8-tetrahydro-1-naphthalenecarboxylic acid

REACTIONS