![3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate structure](/static/products/7080/70807-63-5.webp)
3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate
TL;DR: 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate (CAS 70807-63-5) is a chemical compound with molecular formula C36H58N2O3S and molecular weight 598.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[2-[4-(didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate
Also Known As: 3-(4-{(E)-2-[4-(Didecylamino)phenyl]vinyl}-1-pyridiniumyl)-1, Pyridinium,4-[2-[4-(didecylamino)phenyl]ethenyl]-1-(3-sulfopropyl)-, inner salt
| Molecular Formula | C36H58N2O3S |
|---|---|
| Molecular Weight | 598.42 g/mol |
| LogP | 11.5 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 24 |
| Exact Mass | 598.4168 |
| Heavy Atoms | 42 |
| Complexity | 717.0 |
Chemical Identifiers
| CAS Number | 70807-63-5 |
|---|---|
| SMILES | CCCCCCCCCCN(CCCCCCCCCC)C1=CC=C(C=C1)C=CC2=CC=[N+](C=C2)CCCS(=O)(=O)[O-] |
| InChIKey | TUVYBNWSFFLWHI-UHFFFAOYSA-N |
Product Overview
3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate (CAS 70807-63-5), with molecular formula C36H58N2O3S and molecular weight 598.42 g/mol. IUPAC: 3-[4-[2-[4-(didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate.
Chemical Property Profile of 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate
Property Insights of 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate
The XLogP value of 11.5 indicates that 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate. Following Lipinski's Rule of Five, 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate?
The CAS number of 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate is 70807-63-5.
What is the molecular formula of 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate?
The molecular formula of 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate is C36H58N2O3S.
What is the molecular weight of 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate?
The molecular weight of 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate is 598.42 g/mol.
Where can I buy 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate?
You can request a quote for 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-[2-[4-(Didecylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propane-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.