1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride
TL;DR: 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride (CAS 56516-38-2) is a chemical compound with molecular formula C14H18Cl2N2O and molecular weight 300.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-methyl-6-oxido-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinolin-6-ium;dihydrochloride
Also Known As: 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride, 1,2,4,5-Tetrahydro-11-methyl-3H-azepino(4,5-b)quinoline-6-N-oxide dihydrochloride, 11-methyl-6-oxido-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinolin-6-ium dihydrochloride, 11-Methyl-6-oxo-2,3,4,5-tetrahydro-1H-6lambda~5~-azepino[4,5-b]quinoline--hydrogen chloride (1/2), RefChem:237393
| Molecular Formula | C14H18Cl2N2O |
|---|---|
| Molecular Weight | 300.08 g/mol |
| LogP | 2.31342 |
| Topological Polar Surface Area | 38.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 300.07962 |
| Heavy Atoms | 19 |
| Complexity | 536.65796 |
Chemical Identifiers
| CAS Number | 56516-38-2 |
|---|---|
| SMILES | CC1=C2CCNCCC2=[N+](C3=CC=CC=C13)[O-].Cl.Cl |
Product Overview
1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride (CAS 56516-38-2), with molecular formula C14H18Cl2N2O and molecular weight 300.08 g/mol. IUPAC: 11-methyl-6-oxido-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinolin-6-ium;dihydrochloride.
Chemical Property Profile of 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride
Property Insights of 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride
The XLogP value of 2.31342 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride. With a topological polar surface area (TPSA) of 38.97 Ų, 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride has 1 hydrogen bond donor(s) and 2 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 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride?
The CAS number of 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride is 56516-38-2.
What is the molecular formula of 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride?
The molecular formula of 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride is C14H18Cl2N2O.
What is the molecular weight of 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride?
The molecular weight of 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride is 300.08 g/mol.
Where can I buy 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride?
You can request a quote for 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Azepino(4,5-b)quinoline, 2,3,4,5-tetrahydro-11-methyl-, 6-oxide, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.