![3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate structure](/static/products/4469/4469-74-3.webp)
3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate
TL;DR: 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate (CAS 4469-74-3) is a chemical compound with molecular formula C19H13NO3S and molecular weight 335.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate
Also Known As: 3-benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate, 3-(Pyrido[1,2-b]isoquinolin-5-ium-11-yl)benzene-1-sulfonate
| Molecular Formula | C19H13NO3S |
|---|---|
| Molecular Weight | 335.06 g/mol |
| LogP | 3.1496 |
| Topological Polar Surface Area | 61.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 335.0616 |
| Heavy Atoms | 24 |
| Complexity | 1129.5575 |
Chemical Identifiers
| CAS Number | 4469-74-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=[N+]3C=CC=CC3=C2C4=CC(=CC=C4)S(=O)(=O)[O-] |
Product Overview
3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate (CAS 4469-74-3), with molecular formula C19H13NO3S and molecular weight 335.06 g/mol. IUPAC: 3-benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate.
Chemical Property Profile of 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate
Property Insights of 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate
The XLogP value of 3.1496 indicates that 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate. Following Lipinski's Rule of Five, 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate 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-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate?
The CAS number of 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate is 4469-74-3.
What is the molecular formula of 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate?
The molecular formula of 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate is C19H13NO3S.
What is the molecular weight of 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate?
The molecular weight of 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate is 335.06 g/mol.
Where can I buy 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate?
You can request a quote for 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzo[b]quinolizin-5-ium-11-ylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.