2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione
TL;DR: 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione (CAS 58249-36-8) is a chemical compound with molecular formula C16H12N4O2 and molecular weight 292.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-diphenyl-3H-[1,2,4]triazolo[1,2-a]triazole-5,7-dione
Also Known As: 2,6-diphenyl-3H-[1,2,4]triazolo[1,2-a]triazole-5,7-dione, 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione
| Molecular Formula | C16H12N4O2 |
|---|---|
| Molecular Weight | 292.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.09604 |
| Heavy Atoms | 22 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 58249-36-8 |
|---|---|
| SMILES | C1C(=NN2N1C(=O)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | NWTAVRCABHBIPZ-UHFFFAOYSA-N |
Product Overview
2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione (CAS 58249-36-8), with molecular formula C16H12N4O2 and molecular weight 292.10 g/mol. IUPAC: 2,6-diphenyl-3H-[1,2,4]triazolo[1,2-a]triazole-5,7-dione.
Chemical Property Profile of 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione
Property Insights of 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione. With a topological polar surface area (TPSA) of 56.2 Ų, 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione has 0 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 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione?
The CAS number of 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione is 58249-36-8.
What is the molecular formula of 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione?
The molecular formula of 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione is C16H12N4O2.
What is the molecular weight of 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione?
The molecular weight of 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione is 292.10 g/mol.
Where can I buy 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione?
You can request a quote for 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Diphenyl-3H,5H-[1,2,4]triazolo[1,2-a][1,2,3]triazole-5,7(6H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.