HCID71208373

6-[Bis-(2-hydroxy-ethyl)-amino]-N-(7-chloro-4-oxo-1-phenyl-1,4-dihydro-quinolin-3-yl-methyl)-nicotinamide

6-[bis(2-hydroxyethyl)amino]-N-[(7-chloro-4-oxo-1-phenylquinolin-3-yl)methyl]pyridine-3-carboxamide

C26H25ClN4O4493 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: O=C(NCc1cn(-c2ccccc2)c2cc(Cl)ccc2c1=O)c1ccc(N(CCO)CCO)nc1
InChIKey: RVJQZKKEANLZAL-UHFFFAOYSA-N
分子式: C26H25ClN4O4
平均分子量: 493 g/mol
单同位素质量: 492.156433

COMPUTED

结构计算性质

已同步

XLogP: 3.2
极性表面积: 106 Å²
氢键供体: 3
氢键受体: 7
可旋转键: 9
重原子: 35
形式电荷: 0
复杂度: 754

ALIASES

名称与别名

共 6 条

CHEMBL3679484SCHEMBL14575521RVJQZKKEANLZAL-UHFFFAOYSA-NBDBM100504US8501732, I-646-[Bis-(2-hydroxy-ethyl)-amino]-N-(7-chloro-4-oxo-1-phenyl-1,4-dihydro-quinolin-3-yl-methyl)-nicotinamide

REACTIONS