(3S,4As,8As)-N-(Tert-Butyl)Decahydroisoquinoline-3-Carboxamide (3S,4aS,8aS)-N-叔丁基-十氢异喹啉-3-酰胺

CAS 136465-81-1 MFCD01313226

化学结构图

136465-81-1
SMILES: CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1

化学属性

Mol. FormulaC14H26N2O
Mol. Weight238
Melting Point112-115
TSCANo
Density1.09

别名和识别编码

Chemical Name(3S,4As,8As)-N-(Tert-Butyl)Decahydroisoquinoline-3-Carboxamide
CAS Number136465-81-1
Alfabeta NameASASBUTYLDECAHYDROISOQUINOLINECARBOXAMIDE TERTSN3483(())-----,,
MDL NumberMFCD01313226
Synonym
PubChem Substance ID87561092
Reaxys-RN5430777
EC Number420-380-5
Chemical Name Translation(3S,4aS,8aS)-N-叔丁基-十氢异喹啉-3-酰胺
Beilstein Registry Number5430777
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分类

  • {SNA} Application Index, Asymmetric Synthesis,
  • Application Index, Asymmetric Synthesis, Biochemicals and Reagents, Building Blocks for HIV Protease Inhibitors, Cell Signaling Enzymes, Chemical Synthesis, Chiral Building Blocks, Enzymes, Inhibitors, and Substrates, HIV Protease Reagents & Envelope Proteins, Heterocyclic Building Blocks, Isoquinolines
  • {SNA} Application Index, Asymmetric Synthesis, Biochemicals and Reagents, Building Blocks for HIV Protease Inhibitors, Cell Signaling Enzymes, Chemical Synthesis, Chiral Building Blocks, Enzymes, Inhibitors, and Substrates, HIV Protease Reagents & Envelope Proteins, Heterocyclic Building Blocks, Isoquinolines
  • {

产品应用

  • 各种 HIV-1 蛋白酶抑制剂中存在的片段，目前在临床试验上用于艾滋病的治疗。

相关文献及参考

  • Zhou, L, et al.: Chem. Pharm. Bull., 56, 1147 (2008),
  • Cunico, W., et al.: Lett. Drug Des. Discov., 5, 178 (2008),
  • Righi, G., et al.: Bioorg. Med. Chem., 16, 902 (2008),
  • 1. Tucker, T.J. et al. J. Med. Chem. 35 , 2525, (1992) 摘要
  • 2. Trova, M.P. et al. Bioorg. Med. Chem. Lett. 3 , 1595, (1993)

安全信息

Warnings IRRITANT
WGK Germany3
Signal word
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H412 Harmfutoaquaticlifewithlonglastingeffects 对水生生物有害并具有长期影响。
  • H318 Causes serious eye damage 严重伤害眼睛
Precautionary statements
  • P273 Avoid release to the environment. 避免释放到环境中。
  • 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
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P301+P312+P330
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
Safety Statements
  • S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中，参考特别指示/安全收据说明书；
  • 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；
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置；
  • S22 Do not breathe dust 不要吸入粉尘；
Risk Statements
GHS Symbol
Hazard Codes Xn

系列性分类

  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Alphabetic - Analytical Standards
  4. C - Alphabetic
  5. CH - C
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  4. Heterocyclic Building Blocks - Chiral Building Blocks
  5. Isoquinolines - Heterocyclic Building Blocks
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  4. Heterocyclic Building Blocks - Chiral Building Blocks
  5. Isoquinolines - Heterocyclic Building Blocks

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