2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one
TL;DR: 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one (CAS 156573-15-8) is a chemical compound with molecular formula C15H15NO2 and molecular weight 241.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethyl-3-methyl-7-prop-2-ynoxyisoquinolin-1-one
Also Known As: 2-ethyl-3-methyl-7-prop-2-ynoxy-isoquinolin-1-one, 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one
Technical Specifications
| Molecular Formula | C15H15NO2 |
| Molecular Weight | 241.11028 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.11028 Da |
| Heavy Atoms | 18 |
| Complexity | 404.0 |
| SMILES | CCN1C(=CC2=C(C1=O)C=C(C=C2)OCC#C)C |
| InChIKey | NIDZFVPRONXQBY-UHFFFAOYSA-N |
Chemical Property Profile of 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one
Property Insights of 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one. With a topological polar surface area (TPSA) of 29.5 Ų, 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one?
The CAS number of 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one is 156573-15-8.
What is the molecular formula of 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one?
The molecular formula of 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one is C15H15NO2.
What is the molecular weight of 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one?
The molecular weight of 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one is 241.11028 g/mol.
Where can I buy 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one?
You can request a quote for 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one?
Yes, CoreyChem provides custom synthesis services for 2-Ethyl-3-methyl-7-(prop-2-yn-1-yloxy)isoquinolin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.