3-(2-phenylethyl)pyridine
TL;DR: 3-(2-phenylethyl)pyridine (CAS 172753-33-2) is a chemical compound with molecular formula C16H32Cl2N2S and molecular weight 354.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[(2S,5R)-5-(piperidin-1-ylmethyl)thiolan-2-yl]methyl]piperidine;dihydrochloride
Also Known As: 3-(2-phenylethyl)pyridine, cis-2,5-Di(piperidinomethyl)-1-thiacyclopentane dihydrochloride, Piperidine, 1,1'-((tetrahydro-2,5-thiophenediyl)bis(methylene))bis-, dihydrochloride, cis-, cis-1,1'-((Tetrahydro-2,5-thiophenediyl)bis(methylene))bispiperidine dihydrochloride, 1-[[(2R,5S)-5-(1-piperidylmethyl)thiolan-2-yl]methyl]piperidine dihydr ochloride
| Molecular Formula | C16H32Cl2N2S |
|---|---|
| Molecular Weight | 354.17 g/mol |
| LogP | 4.066 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.16632 |
| Heavy Atoms | 21 |
| Complexity | 243.0026 |
Chemical Identifiers
| CAS Number | 172753-33-2 |
|---|---|
| SMILES | C1CCN(CC1)C[C@H]2CC[C@H](S2)CN3CCCCC3.Cl.Cl |
Product Overview
3-(2-phenylethyl)pyridine (CAS 172753-33-2), with molecular formula C16H32Cl2N2S and molecular weight 354.17 g/mol. IUPAC: 1-[[(2S,5R)-5-(piperidin-1-ylmethyl)thiolan-2-yl]methyl]piperidine;dihydrochloride.
Chemical Property Profile of 3-(2-phenylethyl)pyridine
Property Insights of 3-(2-phenylethyl)pyridine
The XLogP value of 4.066 indicates that 3-(2-phenylethyl)pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, 3-(2-phenylethyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-phenylethyl)pyridine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2-phenylethyl)pyridine?
The CAS number of 3-(2-phenylethyl)pyridine is 172753-33-2.
What is the molecular formula of 3-(2-phenylethyl)pyridine?
The molecular formula of 3-(2-phenylethyl)pyridine is C16H32Cl2N2S.
What is the molecular weight of 3-(2-phenylethyl)pyridine?
The molecular weight of 3-(2-phenylethyl)pyridine is 354.17 g/mol.
Where can I buy 3-(2-phenylethyl)pyridine?
You can request a quote for 3-(2-phenylethyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-phenylethyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-phenylethyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.