Isoquinoline, 4-methyl-
TL;DR: Isoquinoline, 4-methyl- (CAS 1094897-81-0) is a chemical compound with molecular formula C10H9N and molecular weight 143.0735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methylisoquinoline
Also Known As: 4-methylisoquinoline, Isoquinoline, 4-methyl-, 4-methyl-isoquinoline, 4-methylisoquinolilne, methyl-4 isoquinoleine
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H9N |
| Molecular Weight | 143.0735 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 143.0735 Da |
| Heavy Atoms | 11 |
| Complexity | 133.0 |
| SMILES | CC1=CN=CC2=CC=CC=C12 |
| InChIKey | OCOLIBYZTNPPAB-UHFFFAOYSA-N |
Chemical Property Profile of Isoquinoline, 4-methyl-
Property Insights of Isoquinoline, 4-methyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoquinoline, 4-methyl-. With a topological polar surface area (TPSA) of 12.9 Ų, Isoquinoline, 4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 4-methyl- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Isoquinoline, 4-methyl-?
The CAS number of Isoquinoline, 4-methyl- is 1094897-81-0.
What is the molecular formula of Isoquinoline, 4-methyl-?
The molecular formula of Isoquinoline, 4-methyl- is C10H9N.
What is the molecular weight of Isoquinoline, 4-methyl-?
The molecular weight of Isoquinoline, 4-methyl- is 143.0735 g/mol.
Where can I buy Isoquinoline, 4-methyl-?
You can request a quote for Isoquinoline, 4-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isoquinoline, 4-methyl-?
Yes, CoreyChem provides custom synthesis services for Isoquinoline, 4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.