HCID68501706

benzyl 4-[4-(2-aminoethoxy)phenyl]-3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]piperidine-1-carboxylate

benzyl 4-[4-(2-aminoethoxy)phenyl]-3-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]piperidine-1-carboxylate

C34H43N3O6589.7 g/mol

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IDENTITY

结构与身份

标准SMILES: COCCCN1CCOc2ccc(COC3CN(C(=O)OCc4ccccc4)CCC3c3ccc(OCCN)cc3)cc21
InChIKey: CJVLACLOBFSEBZ-UHFFFAOYSA-N
分子式: C34H43N3O6
平均分子量: 589.7 g/mol
单同位素质量: 589.3151861

COMPUTED

结构计算性质

已同步

XLogP: 4
极性表面积: 95.7 Å²
氢键供体: 1
氢键受体: 8
可旋转键: 14
重原子: 43
形式电荷: 0
复杂度: 805

ALIASES

名称与别名

共 6 条

benzyl 4-[4-(2-aminoethoxy)phenyl]-3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]piperidine-1-carboxylatebenzyl 4-[4-(2-aminoethoxy]phenyl]-3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]piperidine-1-carboxylateSCHEMBL3073189CJVLACLOBFSEBZ-UHFFFAOYSA-Nbenzyl 4-[4(2-aminoethoxy]phenyl]-3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benz[1,4]oxazin-6-ylmethoxy]piperidine-1-carboxylatebenzyl 4-[4-(2-aminoethoxy]phenyl]-3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benz[1,4]oxazin-6-ylmethoxy]piperidine-1-carboxylate

REACTIONS