1-[(2-Chloro-1,3-thiazol-5-yl)methyl]-1H-indole-3-carbaldehyde

CAS N/A MFCD03425786

化学结构图

N/A
SMILES: O=CC1=CN(CC2=CN=C(Cl)S2)C2C=CC=CC=21

化学属性

Mol. FormulaC13H9ClN2OS
Mol. Weight276.74
Melting Point140-142°

别名和识别编码

Chemical Name1-[(2-chloro-1,3-thiazol-5-yl)methyl]-1H-indole-3-carbaldehyde
Alfabeta NameCHLOROTHIAZOLYLMETHYLINDOLECARBALDEHYDE H1213513[]()----------,
MDL NumberMFCD03425786
Synonym
PubChem Substance ID329791852
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分类

  • {KO} ReacChlorides
  • {KO} Aldehydes
  • Building Blocks, C12 to C20+, C13 to C27, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Indoles, New Products for Chemical Synthesis, Thiazoles
  • {SNA} Building Blocks, C12 to C20+, C13 to C27, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Indoles, Thiazoles

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Precautionary statements
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P305+P351+P338
Signal word Warning
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Hazard Codes Xn
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • R22 Harmful if swallowed 吞咽有害
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
Hazard statements
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛

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 Acceptors
2
Rotatable Bonds
3
H-bond Donors
0
LogP
3

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. Indoles 吲哚
  5. C13 to C27 - Indoles

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