Tel:

Email:

EN
Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

1-Benzyl-1,4-diazepane

  • CAS No. 4410-12-2

  • Cat. No. CS-W015875
  • Molecule weight190.29
  • Purity≥98%
  • MDL No.None

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

1-Benzyl-1,4-diazepane|CS-W015875

Structure of 4410-12-2

Please choose your location and provide accurate information for you
Size Stock
Price Quantity

* Please select Quantity before adding items.

General Information

  • CAS No. 4410-12-2
  • Cat. No. CS-W015875
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₈N₂
  • Molecular Weight 190.29
  • Synonym(s) N-benzylhomopiperazine
  • SMILES C(N1CCCNCC1)C1=CC=CC=C1

Description

1-Benzyl-1,4-diazepane is a nitrogen-rich heterocyclic scaffold featuring a benzyl-substituted diazepane core. This bench-stable compound integrates a tertiary amine and a pendant aromatic ring, enabling effective coordination in metal-ligand systems. The para-positioned benzyl group enhances solubility in organic media while maintaining favorable steric profiles for molecular recognition.

Application

1-Benzyl-1,4-diazepane serves as a versatile scaffold in medicinal chemistry, offering a rigid, nitrogen-rich heterocyclic core with enhanced solubility and metabolic stability. Its benzylic amine functionality enables straightforward derivatization via alkylation, acylation, or reductive amination, facilitating rapid library expansion. The molecule exhibits excellent bench stability and compatibility with standard purification techniques, making it well-suited for high-throughput synthesis and process development workflows.

Synthesis

  • Route1
    • In-stock
      Homopiperazine|CS-W007768
      505-66-8
    • null|null
      5769-36-8
    • null|null
      100-44-7
    • ~%
    • In-stock
      1-Benzyl-1,4-diazepane|CS-W015875
      4410-12-2

    References

    • EP914319 B1, ; EP 0914319 B1
  • Route2

    References

    • Journal of Organic Chemistry, , vol. 19, p. 1855,1856, 1859

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-H412
Precautionary Statements : P261-P264-P270-P271-P273-P280-P302+P352-P304+P340-P330-P362-P405-P501

Quality Control

To search for quality control of cas , please enter both the product number and the lot/batch number.

Computational Chemistry Data

  • TPSA   15.27
  • LogP   1.4819
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

Other Classifications

Recently Viewed Products

Leave US a Message
Upload Pictures

Key Words

  • 1-Benzyl-1,4-diazepane sigma1-Benzyl-1,4-diazepane manufacturer1-Benzyl-1,4-diazepane price1-Benzyl-1,4-diazepane structure1-Benzyl-1,4-diazepane SDSbuy 1-Benzyl-1,4-diazepane1-Benzyl-1,4-diazepane supplier1-Benzyl-1,4-diazepane uses1-Benzyl-1,4-diazepane molecular weightprice of 1-Benzyl-1,4-diazepane1-Benzyl-1,4-diazepane chemical name formula of 1-Benzyl-1,4-diazepane
This product is not sold in the region.
Confirm
How to get a Lot Number

Lot numbers can be found on the outside label of a product:

ChemScene Label