2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
TL;DR: 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione (CAS 89876-00-6) is a chemical compound with molecular formula C6H7N3O3 and molecular weight 169.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyl-4-methyl-1,2,4-triazine-3,5-dione
Also Known As: 2-acetyl-4-methyl-1,2,4-triazine-3,5(2h,4h)-dione, 2-acetyl-4-methyl-1,2,4-triazine-3,5-dione, 2-acetyl-4-methyl-2H-[1,2,4]triazine-3,5-dione, 1,2,4-Triazine-3,5 -dione,2-acetyl-4-methyl-, 1,2,4-triazine-3,5(2h,4h)-dione,2-acetyl-4-methyl-
| Molecular Formula | C6H7N3O3 |
|---|---|
| Molecular Weight | 169.05 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 70.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 169.04874 |
| Heavy Atoms | 12 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 89876-00-6 |
|---|---|
| SMILES | CC(=O)N1C(=O)N(C(=O)C=N1)C |
| InChIKey | LGHDHNWZJRYUTQ-UHFFFAOYSA-N |
Product Overview
2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione (CAS 89876-00-6), with molecular formula C6H7N3O3 and molecular weight 169.05 g/mol. IUPAC: 2-acetyl-4-methyl-1,2,4-triazine-3,5-dione.
Chemical Property Profile of 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
Property Insights of 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione
The XLogP value of -0.8 indicates that 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione. Following Lipinski's Rule of Five, 2-Acetyl-4-methyl-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 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione?
The CAS number of 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione is 89876-00-6.
What is the molecular formula of 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular formula of 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione is C6H7N3O3.
What is the molecular weight of 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular weight of 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione is 169.05 g/mol.
Where can I buy 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione?
You can request a quote for 2-Acetyl-4-methyl-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 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetyl-4-methyl-1,2,4-triazine-3,5(2H,4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.