1-oxo-2-(2-pyridinylmethyl)-1,2-dihydro-4-isoquinolinecarboxylic acid

CAS N/A MFCD00140333

化学结构图

N/A
SMILES: OC(=O)C1=CN(CC2=CC=CC=N2)C(=O)C2C=CC=CC1=2

化学属性

Mol. FormulaC16H12N2O3
Mol. Weight280.28
Melting Point257°(dec)

别名和识别编码

Chemical Name1-oxo-2-(2-pyridinylmethyl)-1,2-dihydro-4-isoquinolinecarboxylic acid
Alfabeta NameOXOPYRIDINYLMETHYLDIHYDROISOQUINOLINECARBOXYLICACID 122124()--------,
MDL NumberMFCD00140333
Synonym 1-oxo-2-(2-pyridinylmethyl)-1,2-dihydro-4-isoquinolinecarboxylic acid
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分类

  • {KO} CarboxylicAcids
  • {SNA} Building Blocks, C16+, Chemical Synthesis, Heterocyclic Building Blocks, Pyridines

相关文献及参考

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Precautionary statements
  • 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；
Hazard Codes Xi
Risk Statements
  • R36 Irritating to eyes 刺激眼睛

药物吸收、分布、代谢与排泄(ADME)

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

系列性分类

  1. C16+ - Pyridines
  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. Heterocyclic Acids 杂环酸
  5. Quinoline Acids

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