2,6-Bis(PhCH2SEt(4-MePip))Pyridine
TL;DR: 2,6-Bis(PhCH2SEt(4-MePip))Pyridine (CAS 129225-06-5) is a chemical compound with molecular formula C33H45N5S2 and molecular weight 575.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-[2-[[4-[6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfanylmethyl]phenyl]-2-pyridinyl]phenyl]methylsulfanyl]ethyl]piperazine
Also Known As: 2,6-Bis(PhCH2SEt(4-MePip))Pyridine, Piperazine, 1,1'-(2,6-pyridinediylbis(4,1-phenylenemethylenethio-2,1-ethanediyl))bis(4-methyl-, 2,6-Bis(4-(((2-(4-methyl-1-piperazinyl)ethyl)thio)methyl)phenyl)pyridine, 2,6-Bis[4-[[[2-(4-methyl-1-piperazinyl)ethyl]thio]methyl]phenyl]pyridine, 1,1'-[Pyridine-2,6-diylbis(4,1-phenylenemethylenesulfanediylethane-2,1-diyl)]bis(4-methylpiperazine)
| Molecular Formula | C33H45N5S2 |
|---|---|
| Molecular Weight | 575.31 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 76.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 575.31165 |
| Heavy Atoms | 40 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 129225-06-5 |
|---|---|
| SMILES | CN1CCN(CC1)CCSCC2=CC=C(C=C2)C3=NC(=CC=C3)C4=CC=C(C=C4)CSCCN5CCN(CC5)C |
| InChIKey | RRNJUPWYWPYOAG-UHFFFAOYSA-N |
Product Overview
2,6-Bis(PhCH2SEt(4-MePip))Pyridine (CAS 129225-06-5), with molecular formula C33H45N5S2 and molecular weight 575.31 g/mol. IUPAC: 1-methyl-4-[2-[[4-[6-[4-[2-(4-methylpiperazin-1-yl)ethylsulfanylmethyl]phenyl]-2-pyridinyl]phenyl]methylsulfanyl]ethyl]piperazine.
Chemical Property Profile of 2,6-Bis(PhCH2SEt(4-MePip))Pyridine
Property Insights of 2,6-Bis(PhCH2SEt(4-MePip))Pyridine
The XLogP value of 4.8 indicates that 2,6-Bis(PhCH2SEt(4-MePip))Pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Bis(PhCH2SEt(4-MePip))Pyridine. Following Lipinski's Rule of Five, 2,6-Bis(PhCH2SEt(4-MePip))Pyridine has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Bis(PhCH2SEt(4-MePip))Pyridine?
The CAS number of 2,6-Bis(PhCH2SEt(4-MePip))Pyridine is 129225-06-5.
What is the molecular formula of 2,6-Bis(PhCH2SEt(4-MePip))Pyridine?
The molecular formula of 2,6-Bis(PhCH2SEt(4-MePip))Pyridine is C33H45N5S2.
What is the molecular weight of 2,6-Bis(PhCH2SEt(4-MePip))Pyridine?
The molecular weight of 2,6-Bis(PhCH2SEt(4-MePip))Pyridine is 575.31 g/mol.
Where can I buy 2,6-Bis(PhCH2SEt(4-MePip))Pyridine?
You can request a quote for 2,6-Bis(PhCH2SEt(4-MePip))Pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Bis(PhCH2SEt(4-MePip))Pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Bis(PhCH2SEt(4-MePip))Pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.