1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol
TL;DR: 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol (CAS 316359-33-8) is a chemical compound with molecular formula C28H22N4O2S2 and molecular weight 510.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-bis(3-phenoxyphenyl)-1,2,5,6-tetrahydro-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithione
Also Known As: 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol, 3,7-bis(3-phenoxyphenyl)tetrahydro-[1,2,4]triazolo[1,2-a][1,2,4]triazole-1,5-dithione, 1,5-bis(3-phenoxyphenyl)-1,2,5,6-tetrahydro-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithione
| Molecular Formula | C28H22N4O2S2 |
|---|---|
| Molecular Weight | 510.12 g/mol |
| LogP | 6.2638 |
| Topological Polar Surface Area | 49.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 510.1184 |
| Heavy Atoms | 36 |
| Complexity | 1308.5056 |
Chemical Identifiers
| CAS Number | 316359-33-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)C3NC(=S)N4N3C(=S)NC4C5=CC(=CC=C5)OC6=CC=CC=C6 |
Product Overview
1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol (CAS 316359-33-8), with molecular formula C28H22N4O2S2 and molecular weight 510.12 g/mol. IUPAC: 1,5-bis(3-phenoxyphenyl)-1,2,5,6-tetrahydro-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithione.
Chemical Property Profile of 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol
Property Insights of 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol
The XLogP value of 6.2638 indicates that 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.0 Ų, 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol?
The CAS number of 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol is 316359-33-8.
What is the molecular formula of 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol?
The molecular formula of 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol is C28H22N4O2S2.
What is the molecular weight of 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol?
The molecular weight of 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol is 510.12 g/mol.
Where can I buy 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol?
You can request a quote for 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol?
Yes, KEHONG BIO provides custom synthesis services for 1,5-bis(3-phenoxyphenyl)-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dithiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.