2-[(2-Chloro-1,3-thiazol-5-yl)methyl]-1H-isoindole-1,3(2H)-dione

CAS N/A MFCD03617669

化学结构图

N/A
SMILES: O=C1C2C=CC=CC=2C(=O)N1CC1=CN=C(Cl)S1

化学属性

Mol. FormulaC12H7ClN2O2S
Mol. Weight278.71
Melting Point107-108°

别名和识别编码

Chemical Name2-[(2-Chloro-1,3-thiazol-5-yl)methyl]-1H-isoindole-1,3(2H)-dione
Alfabeta NameCHLOROTHIAZOLYLMETHYLISOINDOLEDIONE HH221351132[](())----------,,
MDL NumberMFCD03617669
Synonym 2-[(2-Chloro-1,3-thiazol-5-yl)methyl]-1H-isoindole-1,3(2H)-dione
PubChem Substance ID329789890
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分类

  • {SNA} Building Blocks, C12 to C20+, Chemical Synthesis, Heterocyclic Building Blocks, Thiazoles
  • {KO} ReacChlorides
  • {SA} Building Blocks, C12 to C20+, Chemical Synthesis, Heterocyclic Building Blocks, New Products for Chemical Synthesis, 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 Xi
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • 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
  • 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
3
Rotatable Bonds
2
H-bond Donors
0
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. Thiazoles 噻唑
  5. C12 to C20+ - Thiazoles

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