6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide
TL;DR: 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide (CAS 15248-38-1) is a chemical compound with molecular formula C16H22BrNO2 and molecular weight 339.0834 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-dimethoxy-2-pentylisoquinolin-2-ium bromide
Also Known As: 6,7-Dimethoxy-2-pentylisoquinolinium bromide, 6,7-dimethoxy-2-pentylisoquinolin-2-ium bromide, ISOQUINOLINIUM, 6,7-DIMETHOXY-2-PENTYL-, BROMIDE
Technical Specifications
| Molecular Formula | C16H22BrNO2 |
| Molecular Weight | 339.0834 g/mol |
| XLogP | 0.34 |
| Topological Polar Surface Area (TPSA) | 22.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.0834 Da |
| Heavy Atoms | 20 |
| Complexity | 259.0 |
| SMILES | CCCCC[N+]1=CC2=CC(=C(C=C2C=C1)OC)OC.[Br-] |
| InChIKey | JGBPSBBTVRXDFY-UHFFFAOYSA-M |
Chemical Property Profile of 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide
Property Insights of 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide
The XLogP value of 0.34 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide. With a topological polar surface area (TPSA) of 22.3 Ų, 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide 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
What is the CAS number of 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide?
The CAS number of 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide is 15248-38-1.
What is the molecular formula of 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide?
The molecular formula of 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide is C16H22BrNO2.
What is the molecular weight of 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide?
The molecular weight of 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide is 339.0834 g/mol.
Where can I buy 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide?
You can request a quote for 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide?
Yes, CoreyChem provides custom synthesis services for 6,7-Dimethoxy-2-pentylisoquinolin-2-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.