CAS 1393330-45-4

Benzenemethanamine, 3,5-difluoro-4-[(tetrahydro-2H-pyran-4-yl)methoxy]-, hydrochloride (1:1)

Description:

Benzenemethanamine, 3,5-difluoro-4-[(tetrahydro-2H-pyran-4-yl)methoxy]-, hydrochloride (1:1), with CAS number 1393330-45-4, is a chemical compound characterized by its complex structure that includes a benzene ring substituted with difluoro and methoxy groups, as well as a tetrahydro-pyran moiety. This compound is typically encountered as a hydrochloride salt, which enhances its solubility in water and may influence its pharmacological properties. The presence of fluorine atoms in the structure often contributes to increased lipophilicity and metabolic stability, making such compounds of interest in medicinal chemistry. The tetrahydro-2H-pyran group can provide additional steric hindrance and may affect the compound's interaction with biological targets. Overall, this compound's unique functional groups suggest potential applications in pharmaceuticals, particularly in the development of drugs targeting specific receptors or enzymes. However, detailed studies on its biological activity, toxicity, and pharmacokinetics would be necessary to fully understand its potential uses.

Formula: C₁₃H₁₇F₂NO₂·ClH

InChI: InChI=1S/C13H17F2NO2.ClH/c14-11-5-10(7-16)6-12(15)13(11)18-8-9-1-3-17-4-2-9;/h5-6,9H,1-4,7-8,16H2;1H

InChI key: InChIKey=XWCWFNVSQGFDJT-UHFFFAOYSA-N

SMILES: O(CC1CCOCC1)C2=C(F)C=C(CN)C=C2F.Cl

Synonyms:

• Benzenemethanamine, 3,5-difluoro-4-[(tetrahydro-2H-pyran-4-yl)methoxy]-, hydrochloride (1:1)

[3,5-Difluoro-4-(oxan-4-ylmethoxy)phenyl]methanamine hydrochloride

CAS: 1393330-45-4

Formula: C₁₃H₁₈ClF₂NO₂

Molecular weight: 293.74

Ref: 10-F214442