Name: EF1502 free base
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212712561
Cas No:684645-54-3
常用名:EF1502 free base
别名:Rac-EF 1502, EF-1502, EF1502, EF 1502 racemic, EF 1502, (R,S)-EF 1502
别名:Rac-EF 1502, EF-1502, EF1502, EF 1502 racemic, EF 1502, (R,S)-EF 1502
IUPAC:4-{[4,4-bis(3-methylthiophen-2-yl)but-3-en-1-yl](methyl)amino}-4,5,6,7-tetrahydro-1,2-benzoxazol-3-ol
IUPAC:4-{[4,4-bis(3-methylthiophen-2-yl)but-3-en-1-yl](methyl)amino}-4,5,6,7-tetrahydro-1,2-benzoxazol-3-ol
InChI key:CUESOMOCKVRNIW-UHFFFAOYSA-N

分子式:C22H26N2O2S2
分子量:414.58
氢键供体数 (HBD):1
氢键受体数 (HBA):3
LogP:5.0588546
SMILES:[#6]-[#7](-[#6]-[#6]\[#6]=[#6](\c1sccc1-[#6])-c1sccc1-[#6])-[#6]-1-[#6]-[#6]-[#6]-c2onc(-[#8])c-12
SMILES:[#6]-[#7](-[#6]-[#6]\[#6]=[#6](\c1sccc1-[#6])-c1sccc1-[#6])-[#6]-1-[#6]-[#6]-[#6]-c2onc(-[#8])c-12

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