1-[2-(Methylsulfanyl)phenyl]piperazine 1-[2-(甲基磺酰基)苯基]哌嗪

CAS 1013-24-7 MFCD00040795

化学结构图

1013-24-7
SMILES: CSc1ccccc1N1CCNCC1

化学属性

Mol. FormulaC11H16N2S
Mol. Weight208.32
Melting PointOil (°C)
Boiling Point139 °C at 760 mmHg

别名和识别编码

Chemical Name1-[2-(Methylsulfanyl)phenyl]piperazine
CAS Number1013-24-7
Alfabeta NameMETHYLSULFANYLPHENYLPIPERAZINE 12[]()--
MDL NumberMFCD00040795
Synonym 1-(2-(methylthio)phenyl)piperazine {LY} 1-(2-(methylthio)phenyl)piperazine {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-(methylthio)phenyl)piperazine {} {} {} {} {} {} {} {} {}
Chemical Name Translation1-[2-(甲基磺酰基)苯基]哌嗪
PubChem Substance ID2736895
LabNetwork Molecule IDLN00158341
InChIInChI=1S/C11H16N2S/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
Canonical SMILESCSC1=CC=CC=C1N2CCNCC2
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分类

  • {KO} AminesSecondaryHeteroNH
  • {SNA} Building Blocks, C11, Chemical Synthesis, Heterocyclic Building Blocks, Piperazines

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
Precautionary statements
  • P301+P310
Signal word Danger
Safety Statements
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
Hazard statements
  • H301 Toxic if swallowed 吞食有毒
Hazard Codes T
Risk Statements
  • R25 Toxic if swallowed 吞咽有毒
Storage condition

药物吸收、分布、代谢与排泄(ADME)

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

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. Piperazines 哌嗪
  5. C11 - Piperazines

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