ethyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate 2-(5-溴-3-吲哚基)-2-氧代乙酸乙酯

CAS 17826-11-8 MFCD02657946

化学结构图

17826-11-8
SMILES: CCOC(=O)C(=O)C1=CNC2=CC=C(Br)C=C21

化学属性

Mol. FormulaC12H10BrNO3
Mol. Weight296.12
Melting Point248-249°

别名和识别编码

Chemical Nameethyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate
CAS Number17826-11-8
Alfabeta NameETHYLBROMOINDOLYLOXOACETATE H25132()--------
MDL NumberMFCD02657946
Synonym Ethyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate
PubChem Substance ID329788923
Chemical Name Translation2-(5-溴-3-吲哚基)-2-氧代乙酸乙酯
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分类

  • {KO} AminesSecondaryHeteroNH
  • {SNA} Building Blocks, C12, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Indoles
  • {KO} Esters

安全信息

Warnings IRRITANT
WGK Germany3

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Donors
1
H-bond Acceptors
3
Rotatable Bonds
4
LogP
2

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Halogenated Heterocycles 卤代杂环
  5. Indoles - Halogenated Heterocycles
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Indoles 吲哚
  5. C12 - Indoles

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