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CS-W001157 4
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2,3,4,5-Tetrahydro-1H-1,5-methano-3-benzazepine

  • CAS No. 69718-72-5

  • Cat. No. CS-0003843
  • Purity≥98%
  • MDL No.MFCD18375198

*For research and further manufacturing use only, not for direct human use.

2,3,4,5-Tetrahydro-1H-1,5-methano-3-benzazepine|CS-0003843

Structure of 69718-72-5

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General Information

  • CAS No. 69718-72-5
  • Cat. No. CS-0003843
  • Purity ≥98%
  • MDL No. MFCD18375198
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃N
  • Molecular Weight 159.23
  • Synonym(s) None
  • SMILES C12=CC=CC=C1C3CNCC2C3

Description

This bicyclic scaffold features a rigid, electron-rich heterocyclic core with enhanced metabolic stability. The fused tetrahydrocyclopentane ring imparts conformational constraint, ideal for probing receptor-ligand interactions in CNS-targeted drug discovery.

Application

2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepine serves as a rigid, conformationally constrained scaffold for medicinal chemistry applications. Its fused bicyclic structure provides enhanced metabolic stability and defined spatial orientation, facilitating interactions with biological targets. The compound functions as a key building block in the synthesis of CNS-active agents and exhibits favorable handling characteristics, including bench stability and ease of purification.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   12.03
  • LogP   1.8607
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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