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结构：CN1CCN(S(=O)(=O)c2ccc3c(ccn3C(=O)OC(C)(C)C)c2)CC1
HCID58787188

tert-Butyl 5-((4-methylpiperazin-1-yl)sulfonyl)-1H-indole-1-carboxylate

tert-butyl 5-(4-methylpiperazin-1-yl)sulfonylindole-1-carboxylate

C18H25N3O4S379.5 g/molCAS 519148-73-3
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IDENTITY

结构与身份

标准 SMILES
CN1CCN(S(=O)(=O)c2ccc3c(ccn3C(=O)OC(C)(C)C)c2)CC1
InChIKey
AZTUCDDBRHLQSD-UHFFFAOYSA-N
分子式
C18H25N3O4S
平均分子量
379.5 g/mol
单同位素质量
379.15657746

COMPUTED

结构计算性质

已同步
XLogP
2.2
极性表面积
80.2 Ų
氢键供体
0
氢键受体
6
可旋转键
4
重原子
26
形式电荷
0
复杂度
617

ALIASES

名称与别名

共 16 条
519148-73-3tert-Butyl 5-((4-methylpiperazin-1-yl)sulfonyl)-1H-indole-1-carboxylatetert-butyl 5-(4-methylpiperazin-1-yl)sulfonylindole-1-carboxylatetert-Butyl 5-((4-methylpiperazin-1-yl)-sulfonyl)-1H-indole-1-carboxylatetert-butyl 5-[(4-methylpiperazin-1-yl)sulfonyl]-1H-indole-1-carboxylateMFCD131834281H-Indole-1-carboxylic acid, 5-[(4-methyl-1-piperazinyl)sulfonyl]-, 1,1-dimethylethyl esterSCHEMBL5351570DTXSID20730039AZTUCDDBRHLQSD-UHFFFAOYSA-Ntert-butyl 5-(4-methylpiperazin-1-ylsulfonyl)-1H-indole-1-carboxylateDB-361706F18122tert-Butyl 5-(4-methylpiperazine-1-sulfonyl)-1H-indole-1-carboxylatetert-Butyl5-((4-methylpiperazin-1-yl)sulfonyl)-1H-indole-1-carboxylate2-Methyl-2-propanyl 5-[(4-methyl-1-piperazinyl)sulfonyl]-1H-indole-1-carboxylate

REACTIONS

参与反应

1 条
全部作为反应物作为生成物作为试剂作为催化剂作为溶剂