![1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione structure](/static/products/459/459147-42-3.png)
1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione
TL;DR: 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione (CAS 459147-42-3) is a chemical compound with molecular formula C11H13N4OS+ and molecular weight 249.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione
Also Known As: 1-pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione
| Molecular Formula | C11H13N4OS+ |
|---|---|
| Molecular Weight | 249.08 g/mol |
| LogP | 0.4783 |
| Topological Polar Surface Area | 46.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.08101 |
| Heavy Atoms | 17 |
| Complexity | 467.6196 |
Chemical Identifiers
| CAS Number | 459147-42-3 |
|---|---|
| SMILES | C1COCC[N+]12C(=NNC2=S)C3=CC=NC=C3 |
Product Overview
1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione (CAS 459147-42-3), with molecular formula C11H13N4OS+ and molecular weight 249.08 g/mol. IUPAC: 1-pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione.
Chemical Property Profile of 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione
Property Insights of 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione
The XLogP value of 0.4783 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione. With a topological polar surface area (TPSA) of 46.51 Ų, 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione has 1 hydrogen bond donor(s) and 4 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 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione?
The CAS number of 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione is 459147-42-3.
What is the molecular formula of 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione?
The molecular formula of 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione is C11H13N4OS+.
What is the molecular weight of 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione?
The molecular weight of 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione is 249.08 g/mol.
Where can I buy 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione?
You can request a quote for 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyridin-4-yl-8-oxa-2,3-diaza-5-azoniaspiro[4.5]dec-1-ene-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.