(4Ar,8as)-1-methyldecahydroquinoxaline
TL;DR: (4Ar,8as)-1-methyldecahydroquinoxaline (CAS 6327-21-5) is a chemical compound with molecular formula C9H18N2 and molecular weight 154.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aS,8aR)-4-methyl-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoxaline
Also Known As: (4ar,8as)-1-methyldecahydroquinoxaline, KST-1A6856, Quinoxaline,decahydro-1-methyl-, cis-, (4aS,8aR)-4-methyl-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoxaline
| Molecular Formula | C9H18N2 |
|---|---|
| Molecular Weight | 154.15 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.147 |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 6327-21-5 |
|---|---|
| SMILES | CN1CCN[C@H]2[C@@H]1CCCC2 |
| InChIKey | YKNDCKWOYKGTBO-BDAKNGLRSA-N |
Product Overview
(4Ar,8as)-1-methyldecahydroquinoxaline (CAS 6327-21-5), with molecular formula C9H18N2 and molecular weight 154.15 g/mol. IUPAC: (4aS,8aR)-4-methyl-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoxaline.
Chemical Property Profile of (4Ar,8as)-1-methyldecahydroquinoxaline
Property Insights of (4Ar,8as)-1-methyldecahydroquinoxaline
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4Ar,8as)-1-methyldecahydroquinoxaline. With a topological polar surface area (TPSA) of 15.3 Ų, (4Ar,8as)-1-methyldecahydroquinoxaline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4Ar,8as)-1-methyldecahydroquinoxaline 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 (4Ar,8as)-1-methyldecahydroquinoxaline?
The CAS number of (4Ar,8as)-1-methyldecahydroquinoxaline is 6327-21-5.
What is the molecular formula of (4Ar,8as)-1-methyldecahydroquinoxaline?
The molecular formula of (4Ar,8as)-1-methyldecahydroquinoxaline is C9H18N2.
What is the molecular weight of (4Ar,8as)-1-methyldecahydroquinoxaline?
The molecular weight of (4Ar,8as)-1-methyldecahydroquinoxaline is 154.15 g/mol.
Where can I buy (4Ar,8as)-1-methyldecahydroquinoxaline?
You can request a quote for (4Ar,8as)-1-methyldecahydroquinoxaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4Ar,8as)-1-methyldecahydroquinoxaline?
Yes, KEHONG BIO provides custom synthesis services for (4Ar,8as)-1-methyldecahydroquinoxaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.