HCID22119050

5-(4-Methoxycarbonylmethoxybenzyl)-3-triphenylmethylthiazolidine-2,4-dione

methyl 2-[4-[(2,4-dioxo-3-trityl-1,3-thiazolidin-5-yl)methyl]phenoxy]acetate

C32H27NO5S537.6 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)COc1ccc(CC2SC(=O)N(C(c3ccccc3)(c3ccccc3)c3ccccc3)C2=O)cc1
InChIKey: LABDMBASCGLXNH-UHFFFAOYSA-N
分子式: C32H27NO5S
平均分子量: 537.6 g/mol
单同位素质量: 537.16099414

COMPUTED

结构计算性质

已同步

XLogP: 6.8
极性表面积: 98.2 Å²
氢键供体: 0
氢键受体: 6
可旋转键: 10
重原子: 39
形式电荷: 0
复杂度: 792

ALIASES

名称与别名

共 4 条

SCHEMBL1130749LABDMBASCGLXNH-UHFFFAOYSA-N5-(4-methoxycarbonylmethoxybenzyl)-3-triphenylmethyl-thiazolidine-2,4-dione5-(4-Methoxycarbonylmethoxybenzyl)-3-triphenylmethylthiazolidine-2,4-dione

REACTIONS

参与反应

6 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

查看

uspto-grants-1998_08 · 10.6084/m9.figshare.5104873.v1 · US05798375

查看

Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

查看

uspto-grants-2000_12 · 10.6084/m9.figshare.5104873.v1 · US06159997

查看

uspto-grants-1999_03 · 10.6084/m9.figshare.5104873.v1 · US05886014

查看

uspto-grants-1999_03 · 10.6084/m9.figshare.5104873.v1 · US05886014

查看