6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride
TL;DR: 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride (CAS 1052526-02-9) is a chemical compound with molecular formula C14H15ClN2O2 and molecular weight 278.0822 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile;hydrochloride
Also Known As: 6,7-dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride
Technical Specifications
| Molecular Formula | C14H15ClN2O2 |
| Molecular Weight | 278.0822 g/mol |
| XLogP | 3.16232 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.0822 Da |
| Heavy Atoms | 19 |
| Complexity | 338.0 |
| SMILES | CC1=C(C2=CC(=C(C=C2C(=N1)C)OC)OC)C#N.Cl |
| InChIKey | ACZRUKSGJNLTAG-UHFFFAOYSA-N |
Chemical Property Profile of 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride
Property Insights of 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride
The XLogP value of 3.16232 indicates that 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride has 1 hydrogen bond donor(s) and 4 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-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride?
The CAS number of 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride is 1052526-02-9.
What is the molecular formula of 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride?
The molecular formula of 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride is C14H15ClN2O2.
What is the molecular weight of 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride?
The molecular weight of 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride is 278.0822 g/mol.
Where can I buy 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride?
You can request a quote for 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride?
Yes, CoreyChem provides custom synthesis services for 6,7-Dimethoxy-1,3-dimethylisoquinoline-4-carbonitrile hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.