N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin
TL;DR: N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin (CAS 129119-76-2) is a chemical compound with molecular formula C16H22N4O2 and molecular weight 302.1743 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethyl-4a-hydroxy-3,7,8,10-tetramethyl-4H-benzo[g]pteridin-2-one
Also Known As: 4a-Fletoh, Et-FlOH pseudobase, pseudobase Et-FlOH, N(5)-Ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin, 5-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin
Technical Specifications
| Molecular Formula | C16H22N4O2 |
| Molecular Weight | 302.1743 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 59.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 302.1743 Da |
| Heavy Atoms | 22 |
| Complexity | 508.0 |
| SMILES | CCN1C2=C(C=C(C(=C2)C)C)N(C3=NC(=O)N(CC31O)C)C |
| InChIKey | WKWUIROEBKIJQR-UHFFFAOYSA-N |
Chemical Property Profile of N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin
Property Insights of N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin. With a topological polar surface area (TPSA) of 59.4 Ų, N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin 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 N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin?
The CAS number of N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin is 129119-76-2.
What is the molecular formula of N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin?
The molecular formula of N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin is C16H22N4O2.
What is the molecular weight of N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin?
The molecular weight of N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin is 302.1743 g/mol.
Where can I buy N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin?
You can request a quote for N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin?
Yes, CoreyChem provides custom synthesis services for N(5)-ethyl-4a-hydroxy-3-methyl-4a,5-dihydrolumiflavin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.