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2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride structure
Fine Chemical

2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride

TL;DR: 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride (CAS 1052527-37-3) is a chemical compound with molecular formula C11H13ClFN3OS and molecular weight 289.0452 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]ethanamine;hydrochloride

Also Known As: 2-(5-((4-fluorobenzyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride, 2-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]ethanamine hydrochloride, 2-{5-[(4-fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride

CAS Number
1052527-37-3
Molecular Formula
C11H13ClFN3OS
Molecular Weight
289.0452 g/mol
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Technical Specifications

Molecular FormulaC11H13ClFN3OS
Molecular Weight289.0452 g/mol
XLogP2.424
Topological Polar Surface Area (TPSA)90.2 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds5
Exact Mass289.0452 Da
Heavy Atoms18
Complexity227.0
SMILESC1=CC(=CC=C1CSC2=NN=C(O2)CCN)F.Cl
InChIKeyZYRMDIZNCYRTMM-UHFFFAOYSA-N

Chemical Property Profile of 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride

XLogP
2.424
TPSA (Topological Polar Surface Area)
90.2
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
5
Heavy Atoms
18
Complexity
227.0
Exact Mass
289.0452
Monoisotopic Mass
289.0452
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride

The XLogP value of 2.424 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride. The TPSA of 90.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride. Following Lipinski's Rule of Five, 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride?

The CAS number of 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride is 1052527-37-3.

What is the molecular formula of 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride?

The molecular formula of 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride is C11H13ClFN3OS.

What is the molecular weight of 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride?

The molecular weight of 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride is 289.0452 g/mol.

Where can I buy 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride?

You can request a quote for 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride?

Yes, CoreyChem provides custom synthesis services for 2-{5-[(4-Fluorophenyl)methylthio]-1,3,4-oxadiazol-2-yl}ethylamine, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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