6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione
TL;DR: 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione (CAS 82736-95-6) is a chemical compound with molecular formula C3H2FN3O2 and molecular weight 131.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-2H-1,2,4-triazine-3,5-dione
Also Known As: 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione, 6-fluoro-2H-1,2,4-triazine-3,5-dione, 6-fluoro-1,2,4-triazin-3,5(2h,4h)-dione, 6-fluoro-2H,4H-1,2,4-triazine-3,5-dione, 1,2,4-Triazine-3,5(2H,4H)-dione, 6-fluoro-
| Molecular Formula | C3H2FN3O2 |
|---|---|
| Molecular Weight | 131.01 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.0131 |
| Heavy Atoms | 9 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 82736-95-6 |
|---|---|
| SMILES | C1(=O)C(=NNC(=O)N1)F |
| InChIKey | BWPCMZQPSKDAQH-UHFFFAOYSA-N |
Product Overview
6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione (CAS 82736-95-6), with molecular formula C3H2FN3O2 and molecular weight 131.01 g/mol. IUPAC: 6-fluoro-2H-1,2,4-triazine-3,5-dione.
Chemical Property Profile of 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione
Property Insights of 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione. Following Lipinski's Rule of Five, 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione has 2 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-1,2,4-triazine-3,5(2H,4H)-dione?
The CAS number of 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione is 82736-95-6.
What is the molecular formula of 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular formula of 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione is C3H2FN3O2.
What is the molecular weight of 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular weight of 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione is 131.01 g/mol.
Where can I buy 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione?
You can request a quote for 6-Fluoro-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-1,2,4-triazine-3,5(2H,4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-Fluoro-1,2,4-triazine-3,5(2H,4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.