endo-1,5-Methylenequinolizidine p-toluenesulfonate
TL;DR: endo-1,5-Methylenequinolizidine p-toluenesulfonate (CAS 40179-97-3) is a chemical compound with molecular formula C10H18N+ and molecular weight 152.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azoniatricyclo[5.3.1.01,6]undecane
Also Known As: endo-1,5-Methylenequinolizidine p-toluenesulfonate, 1, 5-Methano-2H-quinolizinium, octahydro-, salt with 4-methylbenzenesulfonic acid (1:1)
| Molecular Formula | C10H18N+ |
|---|---|
| Molecular Weight | 152.14 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 152.14392 |
| Heavy Atoms | 11 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 40179-97-3 |
|---|---|
| SMILES | C1CC[N+]23CCCC(C2)C3C1 |
| InChIKey | FHACJBIFZPSTIA-UHFFFAOYSA-N |
Product Overview
endo-1,5-Methylenequinolizidine p-toluenesulfonate (CAS 40179-97-3), with molecular formula C10H18N+ and molecular weight 152.14 g/mol. IUPAC: 1-azoniatricyclo[5.3.1.01,6]undecane.
Chemical Property Profile of endo-1,5-Methylenequinolizidine p-toluenesulfonate
Property Insights of endo-1,5-Methylenequinolizidine p-toluenesulfonate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for endo-1,5-Methylenequinolizidine p-toluenesulfonate. With a topological polar surface area (TPSA) of 0.0 Ų, endo-1,5-Methylenequinolizidine p-toluenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, endo-1,5-Methylenequinolizidine p-toluenesulfonate has 0 hydrogen bond donor(s) and 0 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 endo-1,5-Methylenequinolizidine p-toluenesulfonate?
The CAS number of endo-1,5-Methylenequinolizidine p-toluenesulfonate is 40179-97-3.
What is the molecular formula of endo-1,5-Methylenequinolizidine p-toluenesulfonate?
The molecular formula of endo-1,5-Methylenequinolizidine p-toluenesulfonate is C10H18N+.
What is the molecular weight of endo-1,5-Methylenequinolizidine p-toluenesulfonate?
The molecular weight of endo-1,5-Methylenequinolizidine p-toluenesulfonate is 152.14 g/mol.
Where can I buy endo-1,5-Methylenequinolizidine p-toluenesulfonate?
You can request a quote for endo-1,5-Methylenequinolizidine p-toluenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for endo-1,5-Methylenequinolizidine p-toluenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for endo-1,5-Methylenequinolizidine p-toluenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.