(5-methyl-1H-1,2,4-triazol-3-yl)urea
TL;DR: (5-methyl-1H-1,2,4-triazol-3-yl)urea (CAS 108039-93-6) is a chemical compound with molecular formula C4H7N5O and molecular weight 141.06506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5-methyl-1H-1,2,4-triazol-3-yl)urea
Also Known As: (5-methyl-1H-[1,2,4]triazol-3-yl)-urea, (5-methyl-1H-1,2,4-triazol-3-yl)urea, 1-(5-methyl-1h-1,2,4-triazol-3-yl)urea
Technical Specifications
| Molecular Formula | C4H7N5O |
| Molecular Weight | 141.06506 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 96.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 141.06506 Da |
| Heavy Atoms | 10 |
| Complexity | 138.0 |
| SMILES | CC1=NC(=NN1)NC(=O)N |
| InChIKey | RZKIIDVQQPDTEU-UHFFFAOYSA-N |
Chemical Property Profile of (5-methyl-1H-1,2,4-triazol-3-yl)urea
Property Insights of (5-methyl-1H-1,2,4-triazol-3-yl)urea
The XLogP value of -0.7 indicates that (5-methyl-1H-1,2,4-triazol-3-yl)urea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 96.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-methyl-1H-1,2,4-triazol-3-yl)urea. Following Lipinski's Rule of Five, (5-methyl-1H-1,2,4-triazol-3-yl)urea has 3 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 (5-methyl-1H-1,2,4-triazol-3-yl)urea?
The CAS number of (5-methyl-1H-1,2,4-triazol-3-yl)urea is 108039-93-6.
What is the molecular formula of (5-methyl-1H-1,2,4-triazol-3-yl)urea?
The molecular formula of (5-methyl-1H-1,2,4-triazol-3-yl)urea is C4H7N5O.
What is the molecular weight of (5-methyl-1H-1,2,4-triazol-3-yl)urea?
The molecular weight of (5-methyl-1H-1,2,4-triazol-3-yl)urea is 141.06506 g/mol.
Where can I buy (5-methyl-1H-1,2,4-triazol-3-yl)urea?
You can request a quote for (5-methyl-1H-1,2,4-triazol-3-yl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5-methyl-1H-1,2,4-triazol-3-yl)urea?
Yes, CoreyChem provides custom synthesis services for (5-methyl-1H-1,2,4-triazol-3-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.