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

  • CAS No. 230615-52-8

  • Cat. No. CS-B0003
  • Purity≥98%
  • MDL No.MFCD11042279

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

2,3,4,5-Tetrahydro-1H-1,5-methano-3-benzazepine hydrochlortde|CS-B0003

Structure of 230615-52-8

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General Information

  • CAS No. 230615-52-8
  • Cat. No. CS-B0003
  • Purity ≥98%
  • MDL No. MFCD11042279
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄ClN
  • Molecular Weight 195.69
  • Synonym(s) None
  • SMILES C12=CC=CC=C1C3CNCC2C3.Cl

Description

This bicyclic amine scaffold features a rigid, electron-rich core with enhanced solubility and stability under standard conditions. The hydrochloride salt form improves crystallinity and handling, enabling efficient incorporation into medicinal chemistry campaigns targeting CNS therapeutics.

Application

2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepine hydrochloride serves as a rigid, conformationally constrained heterocyclic building block for medicinal chemistry and CNS-targeted drug discovery. Its saturated benzene ring fused to a seven-membered azepine core provides enhanced metabolic stability and improved target selectivity. The hydrochloride salt ensures excellent solubility and handling stability, facilitating straightforward purification and integration into standard coupling and functionalization workflows.

Synthesis

  • Route1

    References

    • Kansal, Vinod Kumar; Ahmad, Suhail; Gupta, Amit Patent: US2009/318695 A1, 2009 ; Location in patent: Page/Page column 9 ;

Safety Information

Download SDS
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   2.2825
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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