3,5-Diamino-1,2,4-triazole
TL;DR: 3,5-Diamino-1,2,4-triazole (CAS 1455-77-2) is a chemical compound with molecular formula C2H5N5 and molecular weight 99.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-1,2,4-triazole-3,5-diamine
Also Known As: Guanazole, 1H-1,2,4-Triazole-3,5-diamine, 3,5-DIAMINO-1,2,4-TRIAZOLE, 4H-1,2,4-triazole-3,5-diamine, 3,5-Diamino-s-triazole
| Molecular Formula | C2H5N5 |
|---|---|
| Molecular Weight | 99.05 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 93.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 99.0545 |
| Heavy Atoms | 7 |
| Complexity | 63.0 |
| Melting Point | 399 to 206.1 °C (Decomposes) |
| Solubility | Soluble (NTP, 1992) |
Chemical Identifiers
| CAS Number | 1455-77-2 |
|---|---|
| SMILES | C1(=NC(=NN1)N)N |
| InChIKey | PKWIYNIDEDLDCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Diamino-1,2,4-triazole (CAS 1455-77-2), with molecular formula C2H5N5 and molecular weight 99.05 g/mol. IUPAC: 1H-1,2,4-triazole-3,5-diamine.
Chemical Property Profile of 3,5-Diamino-1,2,4-triazole
Property Insights of 3,5-Diamino-1,2,4-triazole
The XLogP value of -0.7 indicates that 3,5-Diamino-1,2,4-triazole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Diamino-1,2,4-triazole. Following Lipinski's Rule of Five, 3,5-Diamino-1,2,4-triazole has 3 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 3,5-Diamino-1,2,4-triazole?
The CAS number of 3,5-Diamino-1,2,4-triazole is 1455-77-2.
What is the molecular formula of 3,5-Diamino-1,2,4-triazole?
The molecular formula of 3,5-Diamino-1,2,4-triazole is C2H5N5.
What is the molecular weight of 3,5-Diamino-1,2,4-triazole?
The molecular weight of 3,5-Diamino-1,2,4-triazole is 99.05 g/mol.
Where can I buy 3,5-Diamino-1,2,4-triazole?
You can request a quote for 3,5-Diamino-1,2,4-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Diamino-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Diamino-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.