6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione
TL;DR: 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione (CAS 159334-67-5) is a chemical compound with molecular formula C5H6FN3O2 and molecular weight 159.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-2,4-dimethyl-1,2,4-triazine-3,5-dione
Also Known As: 6-fluoro-2,4-dimethyl-1,2,4-triazine-3,5-dione, 6-fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione, 1,2,4-Triazine-3,5(2H,4H)-dione,6-fluoro-2,4-dimethyl-, as-Triazine-3,5(2H,4H)-dione,6-fluoro-2,4-dimethyl-(8CI), 6-fluoro-2,4-dimethyl-2H-[1,2,4]triazine-3,5-dione
| Molecular Formula | C5H6FN3O2 |
|---|---|
| Molecular Weight | 159.04 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.0444 |
| Heavy Atoms | 11 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 159334-67-5 |
|---|---|
| SMILES | CN1C(=O)C(=NN(C1=O)C)F |
| InChIKey | ZQLZNSDSCWVPKN-UHFFFAOYSA-N |
Product Overview
6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione (CAS 159334-67-5), with molecular formula C5H6FN3O2 and molecular weight 159.04 g/mol. IUPAC: 6-fluoro-2,4-dimethyl-1,2,4-triazine-3,5-dione.
Chemical Property Profile of 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione
Property Insights of 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione. With a topological polar surface area (TPSA) of 53.0 Ų, 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione?
The CAS number of 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione is 159334-67-5.
What is the molecular formula of 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione?
The molecular formula of 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione is C5H6FN3O2.
What is the molecular weight of 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione?
The molecular weight of 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione is 159.04 g/mol.
Where can I buy 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione?
You can request a quote for 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-Fluoro-2,4-dimethyl-1,2,4-triazine-3,5(2h,4h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.