Rutalinium
TL;DR: Rutalinium (CAS 27539-40-8) is a chemical compound with molecular formula C16H20NO4+ and molecular weight 290.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2,2,10-trimethyl-3,4-dihydropyrano[2,3-b]quinolin-10-ium-3,7-diol
Also Known As: Rutalinium, 5-methoxy-2,2,10-trimethyl-3,4-dihydropyrano[2,3-b]quinolin-10-ium-3,7-diol, 2H-Pyrano[2,3-b]quinolinium, 3,4-dihydro-3,7-dihydroxy-5-methoxy-2,2,10-trimethyl-, 3,7-DIHYDROXY-5-METHOXY-2,2,10-TRIMETHYL-2H,3H,4H-PYRANO[2,3-B]QUINOLIN-10-IUM, 3,7-Dihydroxy-5-methoxy-2,2,10-trimethyl-3,4-dihydro-2H-pyrano[2,3-b]quinolin-10-ium
| Molecular Formula | C16H20NO4+ |
|---|---|
| Molecular Weight | 290.14 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.13922 |
| Heavy Atoms | 21 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 27539-40-8 |
|---|---|
| SMILES | CC1(C(CC2=C(C3=C(C=CC(=C3)O)[N+](=C2O1)C)OC)O)C |
| InChIKey | YNZXAOOXQYAYLT-UHFFFAOYSA-O |
Product Overview
Rutalinium (CAS 27539-40-8), with molecular formula C16H20NO4+ and molecular weight 290.14 g/mol. IUPAC: 5-methoxy-2,2,10-trimethyl-3,4-dihydropyrano[2,3-b]quinolin-10-ium-3,7-diol.
Chemical Property Profile of Rutalinium
Property Insights of Rutalinium
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rutalinium. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Rutalinium. Following Lipinski's Rule of Five, Rutalinium has 2 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 Rutalinium?
The CAS number of Rutalinium is 27539-40-8.
What is the molecular formula of Rutalinium?
The molecular formula of Rutalinium is C16H20NO4+.
What is the molecular weight of Rutalinium?
The molecular weight of Rutalinium is 290.14 g/mol.
Where can I buy Rutalinium?
You can request a quote for Rutalinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rutalinium?
Yes, KEHONG BIO provides custom synthesis services for Rutalinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.