2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline
TL;DR: 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline (CAS 1403836-05-4) is a chemical compound with molecular formula C15H18FNO and molecular weight 247.13724 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-tert-butyl-8-fluoro-2,3-dimethyl-1H-quinolin-4-one
Also Known As: Tebufloquin M1, 2,3-dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline, Tebufloquin-desacetyl (Metabolite M1), 6-(tert-Butyl)-8-fluoro-2,3-dimethylquinolin-4-ol, J2.437.565J
Technical Specifications
| Molecular Formula | C15H18FNO |
| Molecular Weight | 247.13724 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.13724 Da |
| Heavy Atoms | 18 |
| Complexity | 394.0 |
| SMILES | CC1=C(NC2=C(C1=O)C=C(C=C2F)C(C)(C)C)C |
| InChIKey | WZVYECYZVQCDQX-UHFFFAOYSA-N |
Chemical Property Profile of 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline
Property Insights of 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline
The XLogP value of 4.1 indicates that 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline has 1 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 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline?
The CAS number of 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline is 1403836-05-4.
What is the molecular formula of 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline?
The molecular formula of 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline is C15H18FNO.
What is the molecular weight of 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline?
The molecular weight of 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline is 247.13724 g/mol.
Where can I buy 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline?
You can request a quote for 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline?
Yes, CoreyChem provides custom synthesis services for 2,3-Dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.