CAS 40389-68-2: Hexahydro-1-(3-phenyl-2-propen-1-yl)-1H-1,4-diazepine

Description: Hexahydro-1-(3-phenyl-2-propen-1-yl)-1H-1,4-diazepine, identified by its CAS number 40389-68-2, is a chemical compound that belongs to the class of diazepines, which are characterized by a seven-membered ring containing two nitrogen atoms. This specific compound features a hexahydro structure, indicating that it has a saturated six-membered ring, and it is substituted with a propenyl group that includes a phenyl moiety, contributing to its aromatic characteristics. The presence of the diazepine ring suggests potential biological activity, as many diazepines are known for their pharmacological properties, including anxiolytic and sedative effects. The compound's structure may influence its solubility, stability, and reactivity, making it of interest in medicinal chemistry and drug development. Additionally, the presence of the phenyl group may enhance interactions with biological targets, potentially leading to varied therapeutic applications. However, specific properties such as melting point, boiling point, and solubility would require empirical data for precise characterization.

Formula: C₁₄H₂₀N₂

InChI: InChI=1S/C14H20N2/c1-2-6-14(7-3-1)8-4-11-16-12-5-9-15-10-13-16/h1-4,6-8,15H,5,9-13H2

InChI key: InChIKey=PRSUIGUMFYZTCX-UHFFFAOYSA-N

SMILES: C=1C=CC(=CC1)C=CCN2CCNCCC2

Synonyms:

• 1-(3-Phenylprop-2-en-1-yl)-1,4-diazepane
• 1H-1,4-Diazepine, hexahydro-1-(3-phenyl-2-propen-1-yl)-
• N-Cinnamylhomopiperazine
• Hexahydro-1-(3-phenyl-2-propen-1-yl)-1H-1,4-diazepine
• 1H-1,4-Diazepine, hexahydro-1-(3-phenyl-2-propenyl)-
• 1-[(2E)-3-phenylprop-2-en-1-yl]-1,4-diazepane
• 1-cinnamyl-1,4-diazepane

1-[(2E)-3-phenylprop-2-en-1-yl]-1,4-diazepane

CAS: 40389-68-2

• Purity: 95.0%
• Molecular weight: 216.3280029296875