Name: Eldacimibe
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT212715923
Cas No:141993-70-6
常用名:Eldacimibe
别名:WAY-ACA-147, UNII-4PBL76O2G8, ACA 147
IUPAC:5-{[(3,5-di-tert-butyl-4-hydroxyphenyl)amino]({[4-(2,2-dimethylpropyl)phenyl]methyl}(hexyl)amino)methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
IUPAC:5-{[(3,5-di-tert-butyl-4-hydroxyphenyl)amino]({[4-(2,2-dimethylpropyl)phenyl]methyl}(hexyl)amino)methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
InChI key:HGLFNRGXRCKGSW-UHFFFAOYSA-N

分子式:C39H58N2O5
分子量:634.902
氢键供体数 (HBD):2
氢键受体数 (HBA):5
LogP:11.308917
SMILES:[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7](-[#6]-c1ccc(-[#6]C([#6])([#6])[#6])cc1)-[#6](\[#7]-c1cc(c(-[#8])c(c1)C([#6])([#6])[#6])C([#6])([#6])[#6])=[#6]-1/[#6](=O)-[#8]C([#6])([#6])[#8]-[#6]-1=O
SMILES:[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7](-[#6]-c1ccc(-[#6]C([#6])([#6])[#6])cc1)-[#6](\[#7]-c1cc(c(-[#8])c(c1)C([#6])([#6])[#6])C([#6])([#6])[#6])=[#6]-1/[#6](=O)-[#8]C([#6])([#6])[#8]-[#6]-1=O

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