1-Methyl-1,2,4-triazolidine-3,5-dione
TL;DR: 1-Methyl-1,2,4-triazolidine-3,5-dione (CAS 34771-28-3) is a chemical compound with molecular formula C3H5N3O2 and molecular weight 115.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-1,2,4-triazolidine-3,5-dione
Also Known As: 1-Methylurazole, 1-methyl-1,2,4-triazolidine-3,5-dione, 1-Methyl-6-azauracil, Bicarbamimide, 2-methyl-, 1,2,4-Triazolidine-3,5-dione, 1-methyl-
| Molecular Formula | C3H5N3O2 |
|---|---|
| Molecular Weight | 115.04 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 115.03818 |
| Heavy Atoms | 8 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 34771-28-3 |
|---|---|
| SMILES | CN1C(=O)NC(=O)N1 |
| InChIKey | NENDRBATLNDSTO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-1,2,4-triazolidine-3,5-dione (CAS 34771-28-3), with molecular formula C3H5N3O2 and molecular weight 115.04 g/mol. IUPAC: 1-methyl-1,2,4-triazolidine-3,5-dione.
Chemical Property Profile of 1-Methyl-1,2,4-triazolidine-3,5-dione
Property Insights of 1-Methyl-1,2,4-triazolidine-3,5-dione
The XLogP value of -0.9 indicates that 1-Methyl-1,2,4-triazolidine-3,5-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-1,2,4-triazolidine-3,5-dione. Following Lipinski's Rule of Five, 1-Methyl-1,2,4-triazolidine-3,5-dione has 2 hydrogen bond donor(s) and 2 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 1-Methyl-1,2,4-triazolidine-3,5-dione?
The CAS number of 1-Methyl-1,2,4-triazolidine-3,5-dione is 34771-28-3.
What is the molecular formula of 1-Methyl-1,2,4-triazolidine-3,5-dione?
The molecular formula of 1-Methyl-1,2,4-triazolidine-3,5-dione is C3H5N3O2.
What is the molecular weight of 1-Methyl-1,2,4-triazolidine-3,5-dione?
The molecular weight of 1-Methyl-1,2,4-triazolidine-3,5-dione is 115.04 g/mol.
Where can I buy 1-Methyl-1,2,4-triazolidine-3,5-dione?
You can request a quote for 1-Methyl-1,2,4-triazolidine-3,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-1,2,4-triazolidine-3,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-1,2,4-triazolidine-3,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.