[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one
TL;DR: [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one (CAS 57351-74-3) is a chemical compound with molecular formula C4H3N5O and molecular weight 137.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6H-[1,2,4]triazolo[5,1-c][1,2,4]triazin-4-one
Also Known As: [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one|Hydroxy-7 s-triazolo<2,3-c>triazin|7-Oxo-4,7-dihydro-triazolo(3,2-c)-triazine|6H-[1,2,4]triazolo[5,1-c][1,2,4]triazin-4-one|[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(6H)-one|[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one #|1H,4H-[1,2,4]triazolo[3,2-c][1,2,4]triazin-4-one|LOBCIVCNIBYPOH-UHFFFAOYSA-N
| Molecular Formula | C4H3N5O |
|---|---|
| Molecular Weight | 137.03 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 137.03375 |
| Heavy Atoms | 10 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 57351-74-3 |
|---|---|
| SMILES | C1=NN=C2N=CNN2C1=O |
| InChIKey | LOBCIVCNIBYPOH-UHFFFAOYSA-N |
Product Overview
[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one (CAS 57351-74-3), with molecular formula C4H3N5O and molecular weight 137.03 g/mol. IUPAC: 6H-[1,2,4]triazolo[5,1-c][1,2,4]triazin-4-one.
Chemical Property Profile of [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one
Property Insights of [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one
The XLogP value of -0.8 indicates that [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one. Following Lipinski's Rule of Five, [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one has 1 hydrogen bond donor(s) and 3 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 [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one?
The CAS number of [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one is 57351-74-3.
What is the molecular formula of [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one?
The molecular formula of [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one is C4H3N5O.
What is the molecular weight of [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one?
The molecular weight of [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one is 137.03 g/mol.
Where can I buy [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one?
You can request a quote for [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.